Urs-12-en-28-oic acid, 3-(β-D-arabinopyranosyloxy)-19-hydroxy-, methyl ester, (3β)-

CAS Registry Number®

243470-00-0
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CAS Name

Urs-12-en-28-oic acid, 3-(β-D-arabinopyranosyloxy)-19-hydroxy-, methyl ester, (3β)-

Molecular Formula

C36H58O8

Molecular Mass

618.84

Cite this Page

Urs-12-en-28-oic acid, 3-(β-D-arabinopyranosyloxy)-19-hydroxy-, methyl ester, (3β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=243470-00-0 (retrieved 2024-09-19) (CAS RN: 243470-00-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H58O8/c1-20-11-16-36(30(40)42-8)18-17-33(5)21(28(36)35(20,7)41)9-10-24-32(4)14-13-25(31(2,3)23(32)12-15-34(24,33)6)44-29-27(39)26(38)22(37)19-43-29/h9,20,22-29,37-39,41H,10-19H2,1-8H3/t20-,22-,23+,24-,25+,26-,27+,28-,29+,32+,33-,34-,35-,36+/m1/s1

InChIKey

InChIKey=ZCWVJVNYHGWIEF-XIYRWWEQSA-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@@H](O[C@H]6[C@@H](O)[C@H](O)[C@H](O)CO6)CC5)[H])[H])([C@](C)(O)[C@H](C)CC2)[H]

Canonical SMILES

O=C(OC)C12CCC(C)C(O)(C)C2C3=CCC4C5(C)CCC(OC6OCC(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)CC1

Other Names for this Substance

  • Urs-12-en-28-oic acid, 3-(β-D-arabinopyranosyloxy)-19-hydroxy-, methyl ester, (3β)-