25-Hydroxy-3-epidehydrotumulosic acid

CAS Registry Number®

167775-55-5
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CAS Name

25-Hydroxy-3-epidehydrotumulosic acid

Molecular Formula

C31H48O5

Molecular Mass

500.71

Cite this Page

25-Hydroxy-3-epidehydrotumulosic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=167775-55-5 (retrieved 2024-09-19) (CAS RN: 167775-55-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C31H48O5/c1-18(28(4,5)36)9-10-19(26(34)35)25-22(32)17-31(8)21-11-12-23-27(2,3)24(33)14-15-29(23,6)20(21)13-16-30(25,31)7/h11,13,19,22-25,32-33,36H,1,9-10,12,14-17H2,2-8H3,(H,34,35)/t19-,22-,23+,24-,25+,29-,30-,31+/m1/s1

InChIKey

InChIKey=GDIGQYHXIOMOQU-NEAGZGJDSA-N

SMILES

C[C@]12C=3C([C@]4(C)[C@@](CC3)(C(C)(C)[C@H](O)CC4)[H])=CC[C@]1(C)[C@@]([C@@H](CCC(C(C)(C)O)=C)C(O)=O)([C@H](O)C2)[H]

Canonical SMILES

O=C(O)C(CCC(=C)C(O)(C)C)C1C(O)CC2(C3=CCC4C(C3=CCC12C)(C)CCC(O)C4(C)C)C

Other Names for this Substance

  • Lanosta-7,9(11)-dien-21-oic acid, 3,16,25-trihydroxy-24-methylene-, (3α,16α)-
  • (3α,16α)-3,16,25-Trihydroxy-24-methylenelanosta-7,9(11)-dien-21-oic acid
  • 25-Hydroxy-3-epidehydrotumulosic acid