input word = C00042596

Metabolite InformationStructural formula
Name Hydroxyframoside A
Formula C32H38O14
Mw 646.22615592
CAS RN 219781-74-5
C_ID C00042596 ,
InChIKey WTYCACYRVDPVSW-JFYGURHFNA-N
InChICode InChI=1S/C32H38O14/c1-2-20-21(14-26(37)42-11-10-18-5-8-23(35)24(36)13-18)22(30(41)43-12-9-17-3-6-19(34)7-4-17)16-44-31(20)46-32-29(40)28(39)27(38)25(15-33)45-32/h2-8,13,16,21,25,27-29,31-36,38-40H,9-12,14-15H2,1H3/b20-2+/t21-,25+,27+,28-,29+,31-,32-/m0/s1
SMILES C1=C([C@H](/C(=C\C)/[C@@H](O1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)CC(=O)OCCc1cc(c(cc1)O)O)C(=O)OCCc1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOleaceaeFraxinus ornus Ref.
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