Ursa-12,18-dien-28-oic acid, 2,3-bis(acetyloxy)-

CAS Registry Number®

273379-39-8
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CAS Name

Ursa-12,18-dien-28-oic acid, 2,3-bis(acetyloxy)-

Molecular Formula

C34H50O6

Molecular Mass

554.76

Cite this Page

Ursa-12,18-dien-28-oic acid, 2,3-bis(acetyloxy)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=273379-39-8 (retrieved 2024-09-19) (CAS RN: 273379-39-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C34H50O6/c1-19-12-15-34(29(37)38)17-16-32(8)23(27(34)20(19)2)10-11-26-31(7)18-24(39-21(3)35)28(40-22(4)36)30(5,6)25(31)13-14-33(26,32)9/h10,19,24-26,28H,11-18H2,1-9H3,(H,37,38)/t19-,24?,25+,26-,28?,31+,32-,33-,34+/m1/s1

InChIKey

InChIKey=NKUPBVVFDCQLGE-DCVIYENBSA-N

SMILES

C[C@]12[C@@]3(C)C(C=4[C@@](C(O)=O)(CC3)CC[C@@H](C)C4C)=CC[C@@]1([C@]5(C)[C@@](CC2)(C(C)(C)C(OC(C)=O)C(OC(C)=O)C5)[H])[H]

Canonical SMILES

O=C(OC1CC2(C)C3CC=C4C5=C(C)C(C)CCC5(C(=O)O)CCC4(C)C3(C)CCC2C(C)(C)C1OC(=O)C)C

Other Names for this Substance

  • Ursa-12,18-dien-28-oic acid, 2,3-bis(acetyloxy)-
  • 2ξ,3ξ-Diacetoxyurs-12,18-dien-28-oic acid