input word = C00057697

Metabolite InformationStructural formula
Name Momordin I
Formula C41H64O13
Mw 764.43469213
CAS RN 95851-40-4
C_ID C00057697
InChIKey HWYBGIDROCYPOE-UDXSKONJSA-N
InChICode InChI=1S/C41H64O13/c1-36(2)14-16-41(35(49)50)17-15-39(6)20(21(41)18-36)8-9-24-38(5)12-11-25(37(3,4)23(38)10-13-40(24,39)7)52-34-29(46)30(28(45)31(54-34)32(47)48)53-33-27(44)26(43)22(42)19-51-33/h8,21-31,33-34,42-46H,9-19H2,1-7H3,(H,47,48)(H,49,50)/t21-,22-,23-,24+,25-,26-,27+,28-,29+,30-,31-,33-,34+,38-,39+,40+,41-/m0/s1
SMILES O[C@@H]1[C@H](O)[C@@H](O)[C@H](O[C@@H]2[C@@H](O)[C@H](O[C@@H]3C(C)(C)[C@@](CC[C@]4(C)[C@]5([H])CC=C6[C@@]4(C)CC[C@]7(C(O)=O)[C@@]6([H])CC(C)(C)CC7)([H])[C@]5(C)CC3)O[C@H](C(O)=O)[C@H]2O)OC1
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)