input word = C00057700

Metabolite InformationStructural formula
Name Momordin Ia
Formula C42H66O13
Mw 778.4503422
CAS RN 95851-46-0
C_ID C00057700
InChIKey YLACYPLYIMKUHI-UHFFFAOYSA-N
InChICode InChI=1S/C42H66O13/c1-37(2)15-17-42(36(49)50)18-16-40(6)21(22(42)19-37)9-10-25-39(5)13-12-26(38(3,4)24(39)11-14-41(25,40)7)53-35-30(47)31(29(46)32(55-35)33(48)51-8)54-34-28(45)27(44)23(43)20-52-34/h9,22-32,34-35,43-47H,10-20H2,1-8H3,(H,49,50)
SMILES COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)O)CCC34C)C2(C)C)C(O)C(OC2OCC(O)C(O)C2O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica cochinchinensis Ref.
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OrganismMomordica cochinchinensis
ReferenceTakemoto, T. et al., Annalen, 1965, 685, 237-246 (Mubenins)