input word = C00056803

Metabolite InformationStructural formula
Name Momordicin V
Formula C39H60O12
Mw 720.40847738
CAS RN 1012315-36-4
C_ID C00056803
InChIKey LWNCCLUCDGANTA-BGGZWTQLSA-N
InChICode InChI=1S/C39H60O12/c1-20(2)14-22(49-35-33(48)32(47)31(46)27(18-40)50-35)15-21(3)23-10-11-38(7)34-26(42)16-25-24(39(34,19-41)13-12-37(23,38)6)8-9-28(36(25,4)5)51-30(45)17-29(43)44/h14,16,19,21-24,26-28,31-35,40,42,46-48H,8-13,15,17-18H2,1-7H3,(H,43,44)/t21-,22?,23-,24-,26+,27-,28+,31-,32+,33-,34+,35-,37-,38+,39-/m1/s1
SMILES [H][C@]1([C@H](C)CC(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)/C=C(C)/C)CC[C@@]3(C)[C@]([C@@]4(C=O)CC[C@@]31C)([H])[C@@H](O)C=C([C@@]4([H])CC5)C(C)(C)[C@H]5OC(CC(O)=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
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