input word = C00014031

Metabolite InformationStructural formula
Name Violarvensin
6-C-beta-D-Glucopyranosyl-8-C-beta-D-6-deoxygulopyranosylapigenin
Formula C27H30O14
Mw 578.16355567
CAS RN 201546-08-9
C_ID C00014031 ,
InChIKey MVOUGOXRXQDXDC-AILJZSFINA-N
InChICode InChI=1S/C27H30O14/c1-8-17(31)21(35)23(37)27(39-8)16-20(34)15(26-24(38)22(36)18(32)13(7-28)41-26)19(33)14-11(30)6-12(40-25(14)16)9-2-4-10(29)5-3-9/h2-6,8,13,17-18,21-24,26-29,31-38H,7H2,1H3/t8-,13+,17-,18+,21-,22-,23+,24+,26-,27-/m0/s1
SMILES c1c(ccc(c1)O)c1oc2c(c(=O)c1)c(c(c(c2[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O)O)[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeViolaceaeViola arvensis Ref.
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