(4α,8β,13β)-13-Methyl-17-norkaur-15-en-18-oic acid

CAS Registry Number®

27975-21-9

CAS Name

(4α,8β,13β)-13-Methyl-17-norkaur-15-en-18-oic acid

Molecular Formula

C20H30O2

Molecular Mass

302.45

Cite this Page

(4α,8β,13β)-13-Methyl-17-norkaur-15-en-18-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=27975-21-9 (retrieved 2024-11-04) (CAS RN: 27975-21-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    138-141 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H30O2/c1-17-9-5-15-18(2)7-4-8-19(3,16(21)22)14(18)6-10-20(15,13-17)12-11-17/h11-12,14-15H,4-10,13H2,1-3H3,(H,21,22)/t14-,15-,17+,18+,19+,20-/m0/s1

InChIKey

InChIKey=MVCPPAWXGSLXQJ-VQSWZGCSSA-N

SMILES

C[C@]12[C@]3([C@@]4(C[C@](C)(CC3)C=C4)CC[C@@]1([C@@](C(O)=O)(C)CCC2)[H])[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C3CCC4(C=CC3(CCC12)C4)C

Other Names for this Substance

  • 17-Norkaur-15-en-18-oic acid, 13-methyl-, (4α,8β,13β)-
  • 17-Nor-8β,13β-kaur-15-en-18-oic acid, 13-methyl-
  • 1H-2,10a-Ethenophenanthrene, 17-norkaur-15-en-18-oic acid deriv.
  • (4α,8β,13β)-13-Methyl-17-norkaur-15-en-18-oic acid
  • Hibaen-19-oic acid

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