Cardanolide

CAS Registry Number®

4427-84-3

CAS Name

Cardanolide

Molecular Formula

C23H36O2

Molecular Mass

344.53

Cite this Page

Cardanolide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4427-84-3 (retrieved 2024-11-22) (CAS RN: 4427-84-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H36O2/c1-22-11-4-3-5-16(22)6-7-17-19-9-8-18(15-13-21(24)25-14-15)23(19,2)12-10-20(17)22/h15-20H,3-14H2,1-2H3/t15-,16?,17-,18+,19+,20-,22-,23+/m0/s1

InChIKey

InChIKey=AQARKTASOBROAE-OCYOQFCJSA-N

SMILES

C[C@@]12[C@@]([C@]3([C@](CC1)([C@]4(C)C(CC3)(CCCC4)[H])[H])[H])(CC[C@@]2([C@@]5(COC(=O)C5)[H])[H])[H]

Canonical SMILES

O=C1OCC(C1)C2CCC3C4CCC5CCCCC5(C)C4CCC23C

Other Names for this Substance

  • Cardanolide
  • 24-Norcholan-23-oic acid, 21-hydroxy-, γ-lactone, (14β)-
  • 1H-Cyclopenta[a]phenanthrene-17-propanoic acid, hexadecahydro-β-(hydroxymethyl)-10,13-dimethyl-, γ-lactone, [8R-[8α,9β,10α,13α,14α,17α(R*)]]-
  • 2(3H)-Furanone, 4-(hexadecahydro-10,13-dimethyl-1H-cyclopenta[a]phenanthren-17-yl)dihydro-, [8R-[8α,9β,10α,13α,14α,17α(R*)]]-
  • [8R-[8α,9β,10α,13α,14α,17α(R*)]]-4-(Hexadecahydro-10,13-dimethyl-1H-cyclopenta[a]phenanthren-17-yl)dihydro-2(3H)-furanone

CAS INSIGHTSTM
Targeted protein degrader structure, illustration