(4aR,10aS)-1,3,4,9,10,10a-Hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid

CAS Registry Number®

67494-15-9

CAS Name

(4aR,10aS)-1,3,4,9,10,10a-Hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid

Molecular Formula

C20H28O3

Molecular Mass

316.43

Cite this Page

(4aR,10aS)-1,3,4,9,10,10a-Hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=67494-15-9 (retrieved 2024-11-22) (CAS RN: 67494-15-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    155-160 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H28O3/c1-12(2)14-10-13-6-7-17-19(3,4)8-5-9-20(17,18(22)23)15(13)11-16(14)21/h10-12,17,21H,5-9H2,1-4H3,(H,22,23)/t17-,20-/m0/s1

InChIKey

InChIKey=ATHWSPHADLLZSS-PXNSSMCTSA-N

SMILES

C(O)(=O)[C@@]12C=3C(CC[C@]1(C(C)(C)CCC2)[H])=CC(C(C)C)=C(O)C3

Canonical SMILES

O=C(O)C12C3=CC(O)=C(C=C3CCC1C(C)(C)CCC2)C(C)C

Other Names for this Substance

  • 4a(2H)-Phenanthrenecarboxylic acid, 1,3,4,9,10,10a-hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR,10aS)-
  • 4a(2H)-Phenanthrenecarboxylic acid, 1,3,4,9,10,10a-hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR-trans)-
  • (4aR,10aS)-1,3,4,9,10,10a-Hexahydro-6-hydroxy-1,1-dimethyl-7-(1-methylethyl)-4a(2H)-phenanthrenecarboxylic acid
  • Pisiferic acid
  • (+)-Pisiferic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration