Pentanedioic acid, 3-hydroxy-3-methyl-, 1-[[(1R,2R,6R)-6-[[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl] ester, (3S)-

CAS Registry Number®

92279-92-0

CAS Name

Pentanedioic acid, 3-hydroxy-3-methyl-, 1-[[(1R,2R,6R)-6-[[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl] ester, (3S)-

Molecular Formula

C28H40O8

Molecular Mass

504.61

Cite this Page

Pentanedioic acid, 3-hydroxy-3-methyl-, 1-[[(1R,2R,6R)-6-[[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl] ester, (3S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=92279-92-0 (retrieved 2025-01-07) (CAS RN: 92279-92-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C28H40O8/c1-16-7-8-19-25(2,3)9-6-10-27(19,5)18(16)12-28-20(29)11-17(23(33)24(28)36-28)15-35-22(32)14-26(4,34)13-21(30)31/h11,18-19,23-24,33-34H,1,6-10,12-15H2,2-5H3,(H,30,31)/t18-,19-,23+,24+,26-,27+,28-/m0/s1

InChIKey

InChIKey=QWFKAUWCRFDRMZ-BQWWCXRDSA-N

SMILES

C([C@]12[C@](O1)([C@H](O)C(COC(C[C@@](CC(O)=O)(C)O)=O)=CC2=O)[H])[C@@H]3[C@]4(C)[C@@](CCC3=C)(C(C)(C)CCC4)[H]

Canonical SMILES

O=C(O)CC(O)(C)CC(=O)OCC1=CC(=O)C2(OC2C1O)CC3C(=C)CCC4C(C)(C)CCCC34C

Other Names for this Substance

  • Pentanedioic acid, 3-hydroxy-3-methyl-, 1-[[(1R,2R,6R)-6-[[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl] ester, (3S)-
  • Pentanedioic acid, 3-hydroxy-3-methyl-, mono[[6-[(decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl)methyl]-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl] ester, [1R-[1α,2β,3(S*),6α(1S*,4aS*,8aS*)]]-
  • Pentanedioic acid, 3-hydroxy-3-methyl-, mono[[(1R,2R,6R)-6-[[(1S,4aS,8aS)-decahydro-5,5,8a-trimethyl-2-methylene-1-naphthalenyl]methyl]-2-hydroxy-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl] ester, (3S)-
  • 7-Oxabicyclo[4.1.0]heptane, pentanedioic acid deriv.
  • (+)-Macrophorin D

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