Momordicilin

CAS Registry Number®

189156-40-9
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CAS Name

Momordicilin

Molecular Formula

C36H60O3

Molecular Mass

540.86

Cite this Page

Momordicilin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=189156-40-9 (retrieved 2024-04-30) (CAS RN: 189156-40-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H60O3/c1-10-11-17-36(9,38)39-23-33(6)27-15-20-35(8)28(32(27,5)19-16-29(33)37)13-12-26-30-25(3)24(2)14-18-31(30,4)21-22-34(26,35)7/h11,17,24-28,30,38H,10,12-16,18-23H2,1-9H3/b17-11+/t24-,25+,26-,27-,28-,30+,31-,32+,33-,34-,35-,36?/m1/s1

InChIKey

InChIKey=UQBFECUQCTWGFC-RQSRHSMUSA-N

SMILES

C[C@]12[C@@]([C@]3(C)[C@@](CC1)([C@](COC(/C=C/CC)(C)O)(C)C(=O)CC3)[H])(CC[C@]4([C@@]2(C)CC[C@]5(C)[C@]4([C@@H](C)[C@H](C)CC5)[H])[H])[H]

Canonical SMILES

O=C1CCC2(C)C(CCC3(C)C2CCC4C5C(C)C(C)CCC5(C)CCC43C)C1(C)COC(O)(C=CCC)C

Other Names for this Substance

  • Ursan-3-one, 23-[[(2E)-1-hydroxy-1-methyl-2-penten-1-yl]oxy]-, (4β)-
  • Ursan-3-one, 23-[[(2E)-1-hydroxy-1-methyl-2-pentenyl]oxy]-, (4β)-
  • (4β)-23-[[(2E)-1-Hydroxy-1-methyl-2-penten-1-yl]oxy]ursan-3-one
  • Momordicilin
  • (+)-Momordicilin

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