| C_ID |
CAS ID |
Metabolite |
Molecular formula |
Mw | Organism |
| C00000602 | 27003-73-2 | (+)-Lariciresinol | C20H24O6 | 360.1572885 | Rubia yunnanensis |
| C00000604 | 29388-59-8 | (-)-Secoisolariciresinol | C20H26O6 | 362.17293856 | Rubia yunnanensis |
| C00000659 | 40957-99-1 | Medioresinol | C21H24O7 | 388.15220312 | Rubia wallichiana DECNE |
| C00001024 | 21967-41-9 | Baicalin | C21H18O11 | 446.08491142 | Rubia yunnanensis |
| C00001221 | 143-07-7 | Lauric acid | C12H24O2 | 200.17763001 | Rubia wallichiana DECNE |
| C00002498 | 120-08-1 | Aesculetin dimethyl ether | C11H10O4 | 206.05790881 | Rubia wallichiana DECNE |
| C00002499 | 92-61-5 | Scopoletin | C10H8O4 | 192.04225874 | Rubia wallichiana DECNE |
| C00002591 | 18423-69-3 | Cubebin | C20H20O6 | 356.12598837 | Rubia akane |
| C00002674 | 530-57-4 | Syringic acid | C9H10O5 | 198.05282343 | Rubia yunnanensis |
| C00002682 | 121-34-6 | Vanillic acid | C8H8O4 | 168.04225874 | Rubia yunnanensis |
| C00002785 | 72-48-0 | Alizarin | C14H8O4 | 240.04225874 | Rubia tinctorum |
| C00002785 | 72-48-0 | Alizarin | C14H8O4 | 240.04225874 | Rubia cordifolia |
| C00002786 | 6003-11-8 | 1-Hydroxy-2-methoxyanthraquinone | C15H10O4 | 254.05790881 | Rubia cordifolia |
| C00002786 | 6003-11-8 | 1-Hydroxy-2-methoxyanthraquinone | C15H10O4 | 254.05790881 | Rubia tinctorum |
| C00002786 | 6003-11-8 | 1-Hydroxy-2-methoxyanthraquinone | C15H10O4 | 254.05790881 | Rubia wallichiana DECNE |
| C00002814 | 24094-45-9 | Digiferrugineol | C15H10O4 | 254.05790881 | Rubia cordifolia |
| C00002814 | 24094-45-9 | Digiferrugineol | C15H10O4 | 254.05790881 | Rubia wallichiana |
| C00002828 | 17241-40-6 | 2-Hydroxymethylanthraquinone | C15H10O3 | 238.06299419 | Rubia yunnanensis |
| C00002838 | 478-08-0 | Lucidin | C15H10O5 | 270.05282343 | Rubia wallichiana DECNE |
| C00002838 | 478-08-0 | Lucidin | C15H10O5 | 270.05282343 | Rubia tinctorum |
| C00002839 | 79560-36-4 | 1,3-Dihydroxy-2-methoxymethylanthraquinone | C16H12O5 | 284.06847349 | Rubia wallichiana DECNE |
| C00002856 | 476-41-5 | Pseudopurpurin | C15H8O7 | 300.02700261 | Rubia cordifolia |
| C00002856 | 476-41-5 | Pseudopurpurin | C15H8O7 | 300.02700261 | Rubia tinctorum |
| C00002857 | 81-54-9 | Purpurin | C14H8O5 | 256.03717337 | Rubia tinctorum |
| C00002857 | 81-54-9 | Purpurin | C14H8O5 | 256.03717337 | Rubia wallichiana DECNE |
| C00002857 | 81-54-9 | Purpurin | C14H8O5 | 256.03717337 | Rubia cordifolia |
| C00002862 | 117-02-2 | Rubiadin | C15H10O4 | 254.05790881 | Rubia yunnanensis |
| C00002862 | 117-02-2 | Rubiadin | C15H10O4 | 254.05790881 | Rubia wallichiana DECNE |
| C00002862 | 117-02-2 | Rubiadin | C15H10O4 | 254.05790881 | Rubia tinctorum |
| C00002862 | 117-02-2 | Rubiadin | C15H10O4 | 254.05790881 | Rubia cordifolia |
| C00002864 | 84-54-8 | 2-Methylanthraquinone | C15H10O2 | 222.06807956 | Rubia cordifolia |
| C00003072 | 14259-45-1 | Asperuloside | C18H22O11 | 414.11621155 | Rubia tinctorum |
| C00003558 | 77-52-1 | Ursolic acid | C30H48O3 | 456.3603454 | Rubia wallichiana DECNE |
| C00003672 | 83-46-5 | (-)-beta-Sitosterol | C29H50O | 414.38616622 | Rubia yunnanensis |
| C00003672 | 83-46-5 | (-)-beta-Sitosterol | C29H50O | 414.38616622 | Rubia wallichiana DECNE |
| C00003672 | 83-46-5 | (-)-beta-Sitosterol | C29H50O | 414.38616622 | Rubia cordifolia L. |
| C00003674 | 83-48-7 | beta-Stigmasterol | C29H48O | 412.37051615 | Rubia wallichiana DECNE |
| C00003674 | 83-48-7 | beta-Stigmasterol | C29H48O | 412.37051615 | Rubia yunnanensis |
| C00007204 | 548-29-8 | Isolariciresinol | C20H24O6 | 360.1572885 | Rubia akane |
| C00007204 | 548-29-8 | Isolariciresinol | C20H24O6 | 360.1572885 | Rubia yunnanensis |
| C00019064 | 508-02-1 | Oleanolic acid | C30H48O3 | 456.3603454 | Rubia cordifolia L. |
| C00029473 | 197575-07-8 | 3,3'-bis(3,4-dihydro-4-hydroxy-6-methoxy-2H-1-benzopyran) | C20H22O6 | 358.14163844 | Rubia cordifolia L. |
| C00029633 | 7372-30-7 | Acetylursolic acid | C32H50O4 | 498.37091008 | Rubia wallichiana |
| C00029749 | 25368-11-0 | Asperulosidic acid | C18H24O12 | 432.12677623 | Rubia tinctorum L. |
| C00029749 | 25368-11-0 | Asperulosidic acid | C18H24O12 | 432.12677623 | Rubia peregrina L. |
| C00030333 | 61658-41-1 | Furomollugin | C14H10O4 | 242.05790881 | Rubia cordifolia L. |
| C00030781 | 55481-88-4 | Mollugin | C17H16O4 | 284.104859 | Rubia cordifolia L. |
| C00030781 | 55481-88-4 | Mollugin | C17H16O4 | 284.104859 | Rubia tinctorum |
| C00030781 | 55481-88-4 | Mollugin | C17H16O4 | 284.104859 | Rubia schumannia |
| C00031123 | 106283-67-4 | RA I | C40H48N6O10 | 772.3431918 | Rubia akane |
| C00031123 | 106283-67-4 | RA I | C40H48N6O10 | 772.3431918 | Rubia cordifolia |
| C00031124 | 106235-26-1 | RA II | C40H48N6O9 | 756.34827718 | Rubia akane |
| C00031125 | 70840-66-3 | RA III | C41H50N6O10 | 786.35884186 | Rubia akane |
| C00031126 | 86849-13-0 | RA IV | C41H50N6O10 | 786.35884186 | Rubia akane |
| C00031127 | 140679-93-2 | RA IX | C43H50N6O10 | 810.35884186 | Rubia akane |
| C00031129 | 64725-24-2 | RA V | C40H48N6O9 | 756.34827718 | Rubia akane |
| C00031131 | 138923-14-5 | RA VI | C41H50N6O10 | 786.35884186 | Rubia akane |
| C00031131 | 138923-14-5 | RA VI | C41H50N6O10 | 786.35884186 | Rubia cordifolia |
| C00031132 | 86229-97-2 | RA VII | C41H50N6O9 | 770.36392724 | Rubia akane |
| C00031133 | 138994-83-9 | RA VIII | C42H52N6O10 | 800.37449193 | Rubia cordifolia |
| C00031133 | 138994-83-9 | RA VIII | C42H52N6O10 | 800.37449193 | Rubia akane |
| C00031134 | 140679-94-3 | RA X | C43H52N6O11 | 828.36940655 | Rubia akane |
| C00031134 | 140679-94-3 | RA X | C43H52N6O11 | 828.36940655 | Rubia cordifolia |
| C00031135 | 143277-27-4 | RA XI | C42H50N6O11 | 814.35375648 | Rubia akane |
| C00031135 | 143277-27-4 | RA XI | C42H50N6O11 | 814.35375648 | Rubia cordifolia |
| C00031136 | 143343-98-0 | RA XII | C46H58N6O14 | 918.40110061 | Rubia cordifolia |
| C00031136 | 143343-98-0 | RA XII | C46H58N6O14 | 918.40110061 | Rubia yunnanensis |
| C00031136 | 143343-98-0 | RA XII | C46H58N6O14 | 918.40110061 | Rubia akane |
| C00031137 | 143277-28-5 | RA XIII | C48H60N6O16 | 976.40657992 | Rubia cordifolia |
| C00031137 | 143277-28-5 | RA XIII | C48H60N6O16 | 976.40657992 | Rubia akane |
| C00031138 | 143277-29-6 | RA XIV | C48H58N6O15 | 958.39601523 | Rubia cordifolia |
| C00031138 | 143277-29-6 | RA XIV | C48H58N6O15 | 958.39601523 | Rubia akane |
| C00031139 | 150373-88-9 | RA-XV | C48H60N6O15 | 960.41166529 | Rubia cordifolia |
| C00031139 | 150373-88-9 | RA-XV | C48H60N6O15 | 960.41166529 | Rubia akane |
| C00031140 | 150373-89-0 | RA-XVI | C48H60N6O16 | 976.40657992 | Rubia akane |
| C00031140 | 150373-89-0 | RA-XVI | C48H60N6O16 | 976.40657992 | Rubia cordifolia |
| C00031232 | 26388-47-6 | Rubiadin primeveroside | C26H28O13 | 548.15299098 | Rubia wallichiana DECNE |
| C00031234 | 551930-30-4 | Rubianol a | C30H48O5 | 488.35017464 | Rubia yunnanensis |
| C00031235 | 551930-32-6 | Rubianol b | C32H50O6 | 530.36073933 | Rubia yunnanensis |
| C00031236 | 551930-34-8 | Rubianol c | C32H52O5 | 516.38147477 | Rubia yunnanensis |
| C00031237 | 551930-36-0 | Rubianol d | C32H52O6 | 532.37638939 | Rubia yunnanensis |
| C00031238 | 551930-38-2 | Rubianol e | C34H54O7 | 574.38695408 | Rubia yunnanensis |
| C00031239 | 468732-43-6 | Rubianol g | C30H46O4 | 470.33960996 | Rubia yunnanensis |
| C00031240 | 550376-21-1 | Rubianoside I | C38H60O10 | 676.41864814 | Rubia yunnanensis |
| C00031241 | 644967-42-0 | Rubianoside II | C36H60O8 | 620.42881889 | Rubia yunnanensis |
| C00031242 | 644967-43-1 | Rubianoside III | C36H60O9 | 636.42373351 | Rubia yunnanensis |
| C00031243 | 468732-41-4 | Rubianoside IV | C36H60O10 | 652.41864814 | Rubia yunnanensis |
| C00031244 | 644967-44-2 | Rubianthraquinone | C16H12O5 | 284.06847349 | Rubia yunnanensis |
| C00031245 | 672903-80-9 | Rubiawallin A | C16H12O5 | 284.06847349 | Rubia wallichiana DECNE |
| C00031246 | 672903-81-0 | Rubiawallin B | C16H12O4 | 268.07355887 | Rubia wallichiana DECNE |
| C00031247 | 332102-66-6 | Rubiawallin C | C16H10O5 | 282.05282343 | Rubia wallichiana DECNE |
| C00031248 | 448962-05-8 | Rubinaphthin A | C17H18O9 | 366.09508217 | Rubia yunnanensis |
| C00031525 | 184916-38-9 | Lucidin 3-methyl ether | C16H12O5 | 284.06847349 | Rubia wallichiana DECNE |
| C00031526 | 6268-09-3 | 1-Hydroxy-2-methyl-9,10-anthraquinone | C15H10O3 | 238.06299419 | Rubia tinctorum |
| C00031526 | 6268-09-3 | 1-Hydroxy-2-methyl-9,10-anthraquinone | C15H10O3 | 238.06299419 | Rubia yunnanensis |
| C00031526 | 6268-09-3 | 1-Hydroxy-2-methyl-9,10-anthraquinone | C15H10O3 | 238.06299419 | Rubia wallichiana DECNE |
| C00031527 | 20733-99-7 | 1-Hydroxy-3-methoxyanthraquinone | C15H10O4 | 254.05790881 | Rubia wallichiana DECNE |
| C00031546 | 87686-86-0 | 2-Methyl-1,3,6-trihydroxyanthraquinone | C15H10O5 | 270.05282343 | Rubia wallichiana DECNE |
| C00031546 | 87686-86-0 | 2-Methyl-1,3,6-trihydroxyanthraquinone | C15H10O5 | 270.05282343 | Rubia yunnanensis |
| C00031546 | 87686-86-0 | 2-Methyl-1,3,6-trihydroxyanthraquinone | C15H10O5 | 270.05282343 | Rubia cordifolia |
| C00031985 | 29706-59-0 | Lucidin 3-O-primeveroside | C26H28O14 | 564.14790561 | Rubia yunnanensis |
| C00031985 | 29706-59-0 | Lucidin 3-O-primeveroside | C26H28O14 | 564.14790561 | Rubia tinctorum |
| C00031985 | 29706-59-0 | Lucidin 3-O-primeveroside | C26H28O14 | 564.14790561 | Rubia wallichiana DECNE |
| C00032078 | 3736-59-2 | 1,3-Dihydroxy-2-formylanthraquinone | C15H8O5 | 268.03717337 | Rubia iberica |
| C00032078 | 3736-59-2 | 1,3-Dihydroxy-2-formylanthraquinone | C15H8O5 | 268.03717337 | Rubia cordifolia |
| C00032078 | 3736-59-2 | 1,3-Dihydroxy-2-formylanthraquinone | C15H8O5 | 268.03717337 | Rubia wallichiana DECNE |
| C00032518 | 518-83-2 | 1,3-Dihydroxyanthraquinone | C14H8O4 | 240.04225874 | Rubia tinctorum |
| C00032518 | 518-83-2 | 1,3-Dihydroxyanthraquinone | C14H8O4 | 240.04225874 | Rubia yunnanensis |
| C00032518 | 518-83-2 | 1,3-Dihydroxyanthraquinone | C14H8O4 | 240.04225874 | Rubia wallichiana DECNE |
| C00033228 | 478-06-8 | Munjistin | C15H8O6 | 284.03208799 | Rubia cordifolia |
| C00033228 | 478-06-8 | Munjistin | C15H8O6 | 284.03208799 | Rubia yunnanensis |
| C00033342 | 448962-07-0 | Rubinaphthin B | C22H28O12 | 484.15807636 | Rubia yunnanensis |
| C00033343 | 448962-10-5 | Rubinaphthin C | C22H26O12 | 482.1424263 | Rubia yunnanensis |
| C00033344 | 448962-21-8 | Rubinaphthin D | C28H36O17 | 644.19524973 | Rubia yunnanensis |
| C00033565 | 4339-72-4 | 3-Acetyl oleanolic acid | C32H50O4 | 498.37091008 | Rubia cordifolia L. |
| C00040332 | 518-73-0 | Soranjidiol | C15H10O4 | 254.05790881 | Rubia cordifolia L. |
| C00042707 | 184916-39-0 | Lucidin-omega-ethyl ether | C19H18O5 | 326.11542369 | Rubia tinctorum |
| C00045047 | 157414-07-8 | Rubiarbonone B | C30H48O4 | 472.35526002 | Rubia yunnanensis |
| C00045048 | 246511-26-2 | Rubiarbonone C | C32H50O5 | 514.36582471 | Rubia yunnanensis |
| C00046043 | 5532-41-2 | Sorghumol | C30H50O | 426.38616622 | Rubia oncotricha |
| C00046358 | 130288-59-4 | Rubiarbonol A | C30H50O4 | 474.37091008 | Rubia yunnanensis |
| C00046359 | 130288-60-7 | Rubiarbonol B | C30H50O3 | 458.37599546 | Rubia yunnanensis |
| C00046360 | 142778-14-1 | Rubiarbonol G | C32H52O5 | 516.38147477 | Rubia yunnanensis |
| C00046361 | 468732-39-0 | Rubiarbonone D | C30H48O3 | 456.3603454 | Rubia yunnanensis |
| C00046362 | 468732-40-3 | Rubiarbonone F | C30H46O5 | 486.33452458 | Rubia yunnanensis |
| C00046363 | 142778-16-3 | Rubiarboside A | C38H62O10 | 678.4342982 | Rubia yunnanensis |
| C00046364 | 468732-42-5 | Rubiarboside G | C42H70O14 | 798.47655695 | Rubia yunnanensis |
| C00050674 | 154706-44-2 | 2'-Methoxymollugin | C18H18O5 | 314.11542369 | Rubia cordifolia |
| C00050731 | 643017-29-2 | 5'-Methoxylariciresinol | C21H26O7 | 390.16785319 | Rubia yunnanensis |
| C00058712 | 142778-15-2 | Rubiarbonone A | C32H50O5 | 514.36582471 | Rubia yunnanensis |
| C00058713 | 142182-54-5 | Rubilactone | C15H10O5 | 270.05282343 | Rubia cordifolia |
| C00063920 | 152-84-1 | Ruberythric acid | C25H26O13 | 534.13734092 | Rubia tinctorum |
| C00064540 | 81-64-1 | Quinizarin | C14H8O4 | 240.04225874 | Rubia tinctorum |
| C00064563 | 83312-51-0 | 7-Hydroxy-2-methylanthraquinone | C15H10O3 | 238.06299419 | Rubia tinctorum |
| C00064566 | 84-60-6 | 2,6-Dihydroxyanthraquinone | C14H8O4 | 240.04225874 | Rubia tinctorum |