| C_ID |
CAS ID |
Metabolite |
Molecular formula |
Mw | Organism |
| C00000152 | 7400-08-0 | p-Coumaric acid | C9H8O3 | 164.04734412 | Dianthus caryophyllus |
| C00000351 | 6728-26-3 | (2E)-2-Hexanal | C6H10O | 98.07316494 | Dianthus caryophyllus L. |
| C00000357 | 66-25-1 | Hexanal | C6H12O | 100.08881501 | Dianthus caryophyllus L. |
| C00000358 | 111-27-3 | Hexan-1-ol | C6H14O | 102.10446507 | Dianthus caryophyllus L. |
| C00000615 | 501-16-6 | Caffeic acid | C9H8O4 | 180.04225874 | Dianthus caryophyllus |
| C00000619 | 97-53-0 | Eugenol | C10H12O2 | 164.08372963 | Dianthus caryophyllus |
| C00000674 | 491-70-3 | 5,7,3',4'-Tetrahydroxyflavone | C15H10O6 | 286.04773805 | Dianthus caryophyllus |
| C00000960 | 552-58-9 | Eriodictyol | C15H12O6 | 288.06338812 | Dianthus caryophyllus |
| C00000990 | 60-81-1 | Phloridzin | C21H24O10 | 436.13694699 | Dianthus caryophyllus |
| C00001060 | 491-54-3 | Kaempferide | C16H12O6 | 300.06338812 | Dianthus caryophyllus |
| C00001139 | 512-65-2 | Lychnose | C24H42O21 | 666.22185841 | Dianthus caryophyllus |
| C00001428 | 110-60-1 | 1,4-Butanediamine | C4H12N2 | 88.1000484 | Dianthus caryophyllus |
| C00001536 | 85915-62-4 | Dianthalexin | C14H9NO3 | 239.05824316 | Dianthus caryophyllus |
| C00001537 | 136945-65-8 | Dianthramine | C14H11NO6 | 289.05863709 | Dianthus caryophyllus |
| C00002378 | 2611-67-8 | Cyanin | C27H31O16 | 611.16120995 | Dianthus caryophyllus |
| C00002387 | 17334-58-6 | Pelargonin | C27H31O15 | 595.16629532 | Dianthus caryophyllus |
| C00002510 | 491-80-5 | Biochanin A | C16H12O5 | 284.06847349 | Dianthus caryophyllus |
| C00002526 | 446-72-0 | Genistein | C15H10O5 | 270.05282343 | Dianthus caryophyllus |
| C00002647 | 149-91-7 | Gallic acid | C7H6O5 | 170.0215233 | Dianthus caryophyllus |
| C00002663 | 60-12-8 | 2-Phenylethanol | C8H10O | 122.07316494 | Dianthus caryophyllus |
| C00002668 | 99-50-3 | 3,4-Dihydroxybenzoic acid | C7H6O4 | 154.02660868 | Dianthus caryophyllus |
| C00002682 | 121-34-6 | Vanillic acid | C8H8O4 | 168.04225874 | Dianthus caryophyllus |
| C00003110 | 87-44-5 | beta-Caryophyllene | C15H24 | 204.18780077 | Dianthus caryophyllus L. |
| C00003674 | 83-48-7 | beta-Stigmasterol | C29H48O | 412.37051615 | Dianthus caryophyllus |
| C00003817 | 520-36-5 | Apigenin | C15H10O5 | 270.05282343 | Dianthus caryophyllus |
| C00003820 | 480-44-4 | Acacetin | C16H12O5 | 284.06847349 | Dianthus caryophyllus |
| C00004562 | 480-15-9 | Datiscetin | C15H10O6 | 286.04773805 | Dianthus caryophyllus |
| C00004565 | 520-18-3 | Kaempferol | C15H10O6 | 286.04773805 | Dianthus caryophyllus |
| C00004631 | 117-39-5 | Quercetin | C15H10O7 | 302.04265268 | Dianthus caryophyllus |
| C00004635 | 480-19-3 | Isorhamnetin | C16H12O7 | 316.05830274 | Dianthus caryophyllus |
| C00005165 | 19895-95-5 | Kaempferol 3-O-sophoroside | C27H30O16 | 610.15338491 | Dianthus caryophyllus |
| C00005169 | 17650-84-9 | Kaempferol 3-rutinoside | C27H30O15 | 594.15847029 | Dianthus caryophyllus |
| C00005217 | 55696-58-7 | Kaempferol 3-(2G-glucosylrutinoside) | C33H40O20 | 756.21129372 | Dianthus caryophyllus |
| C00005404 | 23284-18-6 | Quercetin 3-vicianoside | C26H28O16 | 596.13773485 | Dianthus caryophyllus |
| C00005413 | 153-18-4 | Quercetin 3-rutinoside | C27H30O16 | 610.15338491 | Dianthus caryophyllus |
| C00006229 | 23666-13-9 | Vicenin | C27H30O15 | 594.15847029 | Dianthus caryophyllus |
| C00006630 | 18466-51-8 | Callistephin | C21H21O10 | 433.11347189 | Dianthus caryophyllus |
| C00006755 | 165070-68-8 | Pelargonidin 3-(6''-malonylglucoside) | C24H23O13 | 519.11386582 | Dianthus caryophyllus |
| C00006796 | 94977-38-5 | Cyanidin 3-(6''-malonylglucoside) | C24H23O14 | 535.10878045 | Dianthus caryophyllus |
| C00006797 | 104934-16-9 | Cyanidin 3-(6''-malylglucoside) | C25H25O15 | 565.11934513 | Dianthus caryophyllus |
| C00007230 | 979-92-0 | S-Adenosyl-L-homocysteine | C14H20N6O5S | 384.12158852 | Dianthus caryophyllus |
| C00007347 | 29908-03-0 | S-Adenosyl-L-methionine | C15H22N6O5S | 398.13723859 | Dianthus caryophyllus |
| C00007559 | 579-93-1 | N-Benzoylanthranilic acid | C14H11NO3 | 241.07389323 | Dianthus caryophyllus |
| C00007881 | 4547-85-7 | Isosalipurposide | C21H22O10 | 434.12129692 | Dianthus caryophyllus |
| C00009384 | 485-63-2 | 3'-Hydroxydaidzein | C15H10O5 | 270.05282343 | Dianthus caryophyllus |
| C00011097 | 329688-01-9 | 3,5-di-O-(beta-Glucopyranosyl) pelargonidin 6''-O-4, 6'''-O-1-cyclic malate | C31H33O18 | 693.16668925 | Dianthus caryophyllus |
| C00011098 | | Cyanidin 3,5-diglucoside (6'',6'''-malyl diester) | C31H33O19 | 709.16160388 | Dianthus caryophyllus |
| C00011191 | 592522-38-8 | Delphinidin 3-(6''-O-4-malyl-glucosyl)-5-glucoside | C31H35O21 | 743.16708318 | Dianthus caryophyllus |
| C00011192 | 592522-39-9 | Delphinidin 3,5-diglucoside-6''-O-4, 6'''-O-1-cyclic-malyl diester | C31H33O20 | 725.1565185 | Dianthus caryophyllus |
| C00011193 | 592522-40-2 | Delphinidin 3-(6''-O-4-malyl-glucoside)-5-(6'''-O-1-malyl-glucoside) | C35H39O25 | 859.1780418 | Dianthus caryophyllus |
| C00011195 | 592522-42-4 | Kaempferol 3-(6'''-rhamnosyl-2'''-(6-malyl-glucosyl)-glucoside) | C37H44O24 | 872.22225234 | Dianthus caryophyllus |
| C00011196 | 592522-41-3 | Apigenin 6-C-glucosyl-7-O-(6-malyl-glucoside) | C31H34O19 | 710.16942891 | Dianthus caryophyllus |
| C00013749 | 188825-70-9 | Kaempferol 3-glucosyl-(1->4)-rhamnosyl-(1->2)-glucoside | C33H40O20 | 756.21129372 | Dianthus caryophyllus |
| C00013820 | 345306-69-6 | Kaempferol 4'-methyl ether 3-(2Glc-glucosylrutinoside) | C34H42O20 | 770.22694379 | Dianthus caryophyllus |
| C00014811 | 104078-08-2 | Delphinidin 3-(6-malonylglucoside)-5-glucoside | C30H33O20 | 713.1565185 | Dianthus caryophyllus |
| C00016987 | 4674-50-4 | (+)-Nootkatone | C15H22O | 218.16706532 | Dianthus caryophyllus |
| C00019221 | 120-51-4 | Benzyl benzoate | C14H12O2 | 212.08372963 | Dianthus caryophyllus L. |
| C00029811 | 100-51-6 | Benzenemethanol | C7H8O | 108.05751488 | Dianthus caryophyllus L. |
| C00030828 | 124-19-6 | Nonadienal | C9H18O | 142.1357652 | Dianthus caryophyllus L. |
| C00034452 | 100-52-7 | Benzaldehyde | C7H6O | 106.04186481 | Dianthus caryophyllus L. |
| C00035059 | 118-58-1 | Benzyl salicylate | C14H12O3 | 228.07864425 | Dianthus caryophyllus |
| C00036488 | 626-93-7 | 2-Hexanol | C6H14O | 102.10446507 | Dianthus caryophyllus L. |
| C00036546 | 544-12-7 | 3-Hexen-1-ol | C6H12O | 100.08881501 | Dianthus caryophyllus L. |
| C00040794 | 1466-76-8 | 2,6-Dimethoxy-benzoic acid | C9H10O4 | 182.05790881 | Dianthus caryophyllus |
| C00055911 | 6789-88-4 | Hexyl benzoate | C13H18O2 | 206.13067982 | Dianthus caryophyllus |
| C00059138 | 109437-82-3 | Methoxydianthramide B | C15H13NO4 | 271.08445791 | Dianthus caryophyllus |
| C00059286 | 115610-35-0 | Methoxydianthramide M | C16H15NO6 | 317.08993722 | Dianthus caryophyllus |
| C00059287 | 115610-36-1 | Avenanthramide D | C16H13NO4 | 283.08445791 | Dianthus caryophyllus |
| C00059288 | 115610-37-2 | Dianthramide R | C14H11NO5 | 273.06372247 | Dianthus caryophyllus |
| C00059289 | 115610-38-3 | Hydroxydianthramide R | C14H11NO6 | 289.05863709 | Dianthus caryophyllus |
| C00059290 | 115610-39-4 | Methoxydianthramide R | C15H13NO6 | 303.07428716 | Dianthus caryophyllus |
| C00059291 | 115610-40-7 | Hydroxydianthramide S | C14H11NO5 | 273.06372247 | Dianthus caryophyllus |
| C00059369 | 119-53-9 | Benzoin | C14H12O2 | 212.08372963 | Dianthus caryophyllus |
| C00059423 | 1206902-14-8 | 3-[(O-beta-D-Glucopyranosyl-(1->2)-O-beta-D-glucopyranosyl-(1->2)-O-[6-deoxy-alpha-L-mannopyranosyl-(1->6)]-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one | C39H50O25 | 918.26411715 | Dianthus caryophyllus |
| C00059447 | 122-27-0 | m-Cresyl phenyl acetate | C15H14O2 | 226.09937969 | Dianthus caryophyllus |
| C00059663 | 13316-98-8 | Dianthramide S | C14H11NO4 | 257.06880785 | Dianthus caryophyllus |
| C00059759 | 136945-66-9 | Methoxydianthramide A methyl ester | C17H17NO5 | 315.11067266 | Dianthus caryophyllus |
| C00059760 | 136945-67-0 | Hydroxydianthalexin S | C14H9NO4 | 255.05315778 | Dianthus caryophyllus |
| C00059848 | 140220-07-1 | Methoxydianthramide A | C16H15NO5 | 301.0950226 | Dianthus caryophyllus |
| C00061207 | 27400-78-8 | Eicosene | C20H40 | 280.31300128 | Dianthus caryophyllus |
| C00061355 | 3034-08-0 | 4'-Methoxyflavanone | C16H14O3 | 254.09429431 | Dianthus caryophyllus |
| C00061780 | 429692-33-1 | 3-[(O-beta-D-Glucopyranosyl-(1->2)-O-6-deoxy-alpha-L-mannopyranosyl-(1->6)-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one | C33H40O20 | 756.21129372 | Dianthus caryophyllus |
| C00062445 | 614759-62-5 | 3-[(O-beta-D-Glucopyranosyl-(1->4)-O-6-deoxy-alpha-L-mannopyranosyl-(1->2)-beta-D-glucopyranosyl)oxy]-5,7-dihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one | C34H42O20 | 770.22694379 | Dianthus caryophyllus |
| C00062601 | 6515-37-3 | 4'-Hydroxyflavanone | C15H12O3 | 240.07864425 | Dianthus caryophyllus |
| C00062795 | 72200-74-9 | 3-Hexen-1-ol benzoate | C13H16O2 | 204.11502975 | Dianthus caryophyllus |
| C00063185 | 85915-70-4 | Hydroxydianthramide B | C14H11NO4 | 257.06880785 | Dianthus caryophyllus |
| C00063424 | 93289-90-8 | Methoxydianthramide S | C15H13NO5 | 287.07937253 | Dianthus caryophyllus |