input word = C00056382

Metabolite InformationStructural formula
Name Kuguaglycoside D
Formula C30H50O4
Mw 474.37091008
CAS RN 1041631-94-0
C_ID C00056382
InChIKey WCKZLYQEEPCCGL-RMDIKJGVSA-N
InChICode InChI=1S/C36H60O9/c1-19(2)14-21(39)15-20(3)22-10-11-35(7)31-25(44-32-30(43)29(42)28(41)26(17-37)45-32)16-24-23(8-9-27(40)33(24,4)5)36(31,18-38)13-12-34(22,35)6/h14,16,20-23,25-32,37-43H,8-13,15,17-18H2,1-7H3/t20-,21?,22-,23-,25+,26-,27+,28-,29+,30-,31+,32-,34-,35+,36-/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)CC(O)/C=C(C)/C)(C)[C@]3(C)CC4)([H])[C@]4(CO)[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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