input word = C00038088

Metabolite InformationStructural formula
Name (19R,23E)-5beta,19-Epoxy-19,25-dimethoxycucurbita-6,23-dien-3beta-ol
Formula C32H52O4
Mw 500.38656015
CAS RN 85372-72-1
C_ID C00038088 ,
InChIKey PCHCXXYKHCXPSQ-GPUVXWQFNA-N
InChICode InChI=1S/C32H52O4/c1-21(11-10-16-27(2,3)35-9)22-14-17-30(7)23-15-18-32-24(12-13-25(33)28(32,4)5)31(23,26(34-8)36-32)20-19-29(22,30)6/h10,15-16,18,21-26,33H,11-14,17,19-20H2,1-9H3/b16-10+/t21-,22-,23+,24+,25+,26-,29-,30+,31?,32+/m1/s1
SMILES [C@@H]1([C@]23[C@H]4[C@](C([C@H](CC4)O)(C)C)(C=C[C@H]2[C@]2([C@](CC3)([C@H](CC2)[C@@H](C/C=C/C(OC)(C)C)C)C)C)O1)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeMomordica charantia Ref.
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