(9β,10α,16α)-20,24-Epoxy-2-(β-D-glucopyranosyloxy)-16-hydroxy-4,4,9,14-tetramethyl-19-norchola-1,5,23-triene-3,11,22-trione

CAS Registry Number®

1345690-59-6

CAS Name

(9β,10α,16α)-20,24-Epoxy-2-(β-D-glucopyranosyloxy)-16-hydroxy-4,4,9,14-tetramethyl-19-norchola-1,5,23-triene-3,11,22-trione

Molecular Formula

C33H44O11

Molecular Mass

616.70

Cite this Page

(9β,10α,16α)-20,24-Epoxy-2-(β-D-glucopyranosyloxy)-16-hydroxy-4,4,9,14-tetramethyl-19-norchola-1,5,23-triene-3,11,22-trione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1345690-59-6 (retrieved 2024-11-05) (CAS RN: 1345690-59-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H44O11/c1-29(2)15-7-8-20-30(3)12-17(35)26(33(6)21(36)9-10-42-33)31(30,4)13-22(37)32(20,5)16(15)11-18(27(29)41)43-28-25(40)24(39)23(38)19(14-34)44-28/h7,9-11,16-17,19-20,23-26,28,34-35,38-40H,8,12-14H2,1-6H3/t16-,17-,19-,20+,23-,24+,25-,26+,28-,30+,31-,32+,33+/m1/s1

InChIKey

InChIKey=WBITZIQWEJYFNO-GSNQANGESA-N

SMILES

C[C@]12[C@]3([C@](C)([C@]4(C(=CC3)C(C)(C)C(=O)C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)=C4)[H])C(=O)C[C@]1(C)[C@]([C@H](O)C2)([C@]6(C)C(=O)C=CO6)[H])[H]

Canonical SMILES

O=C1C=COC1(C)C2C(O)CC3(C)C4CC=C5C(C=C(OC6OC(CO)C(O)C(O)C6O)C(=O)C5(C)C)C4(C(=O)CC23C)C

Other Names for this Substance

  • 19-Norchola-1,5,23-triene-3,11,22-trione, 20,24-epoxy-2-(β-D-glucopyranosyloxy)-16-hydroxy-4,4,9,14-tetramethyl-, (9β,10α,16α)-
  • (9β,10α,16α)-20,24-Epoxy-2-(β-D-glucopyranosyloxy)-16-hydroxy-4,4,9,14-tetramethyl-19-norchola-1,5,23-triene-3,11,22-trione

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles