| Name |
3-[[2-O-[5-(alpha-D-Glucopyranosyloxy)-3-hydroxy-3-methyl-1,5-dioxopentyl]-beta-D-glucopyranosyl]oxy]-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-methoxy-4H-1-benzopyran-4-one |
| Formula |
C35H42O22 |
| Mw |
814.21677303 |
| CAS RN |
98827-57-7 |
| C_ID |
C00063555
|
| InChIKey |
LLEXIJPSIFQRPX-QDBQLUHKSA-N |
| InChICode |
InChI=1S/C35H42O22/c1-35(49,9-20(42)55-33-27(48)25(46)22(43)17(10-36)52-33)8-19(41)54-32-26(47)23(44)18(11-37)53-34(32)57-31-24(45)21-14(39)7-15(40)29(51-3)30(21)56-28(31)12-4-5-13(38)16(6-12)50-2/h4-7,17-18,22-23,25-27,32-34,36-40,43-44,46-49H,8-11H2,1-3H3/t17-,18-,22-,23-,25+,26+,27-,32-,33-,34+,35?/m1/s1 |
| SMILES |
COc1cc(-c2oc3c(OC)c(O)cc(O)c3c(=O)c2OC2OC(CO)C(O)C(O)C2OC(=O)CC(C)(O)CC(=O)OC2OC(CO)C(O)C(O)C2O)ccc1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus limon  | Ref. |
|
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