Olean-12-eno[3,2-c]isoxazol-28-oic acid, methyl ester

CAS Registry Number®

42273-05-2

CAS Name

Olean-12-eno[3,2-c]isoxazol-28-oic acid, methyl ester

Molecular Formula

C32H47NO3

Molecular Mass

493.72

Cite this Page

Olean-12-eno[3,2-c]isoxazol-28-oic acid, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=42273-05-2 (retrieved 2024-10-04) (CAS RN: 42273-05-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H47NO3/c1-27(2)13-15-32(26(34)35-8)16-14-30(6)21(22(32)18-27)9-10-24-29(5)17-20-19-36-33-25(20)28(3,4)23(29)11-12-31(24,30)7/h9,19,22-24H,10-18H2,1-8H3/t22-,23-,24+,29-,30+,31+,32-/m0/s1

InChIKey

InChIKey=KGRUVADREYTUHF-QROXQBBHSA-N

SMILES

C(OC)(=O)[C@]12[C@](C=3[C@@](C)(CC1)[C@@]4(C)[C@](CC3)([C@]5(C)[C@@](CC4)(C(C)(C)C=6C(C5)=CON6)[H])[H])(CC(C)(C)CC2)[H]

Canonical SMILES

O=C(OC)C12CCC3(C(=CCC4C5(C)CC6=CON=C6C(C)(C)C5CCC43C)C2CC(C)(C)CC1)C

Other Names for this Substance

  • Olean-12-eno[3,2-c]isoxazol-28-oic acid, methyl ester

CAS INSIGHTSTM
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