(4α)-15-Oxokaur-16-en-18-oic acid

CAS Registry Number®

6620-00-4

CAS Name

(4α)-15-Oxokaur-16-en-18-oic acid

Molecular Formula

C20H28O3

Molecular Mass

316.43

Cite this Page

(4α)-15-Oxokaur-16-en-18-oic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6620-00-4 (retrieved 2025-01-07) (CAS RN: 6620-00-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    197-201 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H28O3/c1-12-13-5-6-15-18(2)8-4-9-19(3,17(22)23)14(18)7-10-20(15,11-13)16(12)21/h13-15H,1,4-11H2,2-3H3,(H,22,23)/t13-,14+,15+,18-,19-,20-/m1/s1

InChIKey

InChIKey=WQBNGXOJBVBQKP-SUIOEDAWSA-N

SMILES

O=C1[C@]23[C@]([C@@]4(C)[C@](CC2)([C@@](C(O)=O)(C)CCC4)[H])(CC[C@](C3)(C1=C)[H])[H]

Canonical SMILES

O=C(O)C1(C)CCCC2(C)C1CCC34C(=O)C(=C)C(CCC32)C4

Other Names for this Substance

  • Kaur-16-en-18-oic acid, 15-oxo-, (4α)-
  • Kaur-16-en-18-oic acid, 15-oxo-
  • (4α)-15-Oxokaur-16-en-18-oic acid

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