input word = C00056380

Metabolite InformationStructural formula
Name Kuguaglycoside B
Formula C37H62O8
Mw 634.44446896
CAS RN 1040903-38-5
C_ID C00056380
InChIKey SIFXZLRBHSSMMW-WTYQRWLHSA-N
InChICode InChI=1S/C37H62O8/c1-21(11-10-15-33(2,3)43-9)22-14-16-37(8)31-25(44-32-30(42)29(41)28(40)26(20-38)45-32)19-24-23(12-13-27(39)34(24,4)5)35(31,6)17-18-36(22,37)7/h10,15,19,21-23,25-32,38-42H,11-14,16-18,20H2,1-9H3/b15-10+/t21-,22-,23-,25+,26-,27+,28-,29+,30-,31-,32-,35+,36-,37+/m1/s1
SMILES O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O[C@@H]2[C@]([C@@](CC[C@]3([H])[C@H](C)C/C=C/C(C)(C)OC)(C)[C@]3(C)CC4)([H])[C@]4(C)[C@@](CC[C@H](O)C5(C)C)([H])C5=C2)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
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