input word = C00064092

Metabolite InformationStructural formula
Name Vincosamide 11,6'-di-O-beta-D-glucopyranoside
Formula C38H50N2O19
Mw 838.30077743
CAS RN 1914972-45-4
C_ID C00064092
InChIKey QOBDFGHQWMXHBL-PDWJNKCCSA-N
InChICode InChI=1S/C38H50N2O19/c1-2-14-17-8-20-24-16(15-4-3-13(7-19(15)39-24)55-37-32(50)29(47)26(44)22(10-42)57-37)5-6-40(20)34(52)18(17)11-53-35(14)59-38-33(51)30(48)27(45)23(58-38)12-54-36-31(49)28(46)25(43)21(9-41)56-36/h2-4,7,11,14,17,20-23,25-33,35-39,41-51H,1,5-6,8-10,12H2/t14-,17+,20-,21-,22-,23-,25-,26-,27-,28+,29+,30+,31-,32-,33-,35+,36-,37-,38+/m1/s1
SMILES C=CC1C(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)OC=C2C(=O)N3CCc4c([nH]c5cc(OC6OC(CO)C(O)C(O)C6O)ccc45)C3CC21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCornaceaeCamptotheca acuminata Ref.
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