(3α,16α)-3-(Acetyloxy)-16-hydroxy-24-methyllanosta-8,25-dien-21-oic acid

CAS Registry Number®

201045-20-7

CAS Name

(3α,16α)-3-(Acetyloxy)-16-hydroxy-24-methyllanosta-8,25-dien-21-oic acid

Molecular Formula

C33H52O5

Molecular Mass

528.76

Cite this Page

(3α,16α)-3-(Acetyloxy)-16-hydroxy-24-methyllanosta-8,25-dien-21-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=201045-20-7 (retrieved 2025-01-07) (CAS RN: 201045-20-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H52O5/c1-19(2)20(3)10-11-22(29(36)37)28-25(35)18-33(9)24-12-13-26-30(5,6)27(38-21(4)34)15-16-31(26,7)23(24)14-17-32(28,33)8/h20,22,25-28,35H,1,10-18H2,2-9H3,(H,36,37)/t20?,22-,25-,26+,27-,28+,31-,32-,33+/m1/s1

InChIKey

InChIKey=ZCMJUAGNOJTZBJ-MJWPTZKTSA-N

SMILES

C[C@]12[C@@](C)([C@@]([C@@H](CCC(C(C)=C)C)C(O)=O)([C@H](O)C1)[H])CCC3=C2CC[C@@]4([C@]3(C)CC[C@@H](OC(C)=O)C4(C)C)[H]

Canonical SMILES

O=C(OC1CCC2(C3=C(CCC2C1(C)C)C4(C)CC(O)C(C(C(=O)O)CCC(C(=C)C)C)C4(C)CC3)C)C

Other Names for this Substance

  • Lanosta-8,25-dien-21-oic acid, 3-(acetyloxy)-16-hydroxy-24-methyl-, (3α,16α)-
  • (3α,16α)-3-(Acetyloxy)-16-hydroxy-24-methyllanosta-8,25-dien-21-oic acid
  • Tsugaric acid B
  • 3α-Acetoxy-16α-hydroxy-24ξ-methyl-5α-lanosta-8,25-dien-21-oic acid

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