Atis-13-en-3-one, 16-hydroxy-, (5β,8α,9β,10α,12α)-

CAS Registry Number®

119642-81-8

CAS Name

Atis-13-en-3-one, 16-hydroxy-, (5β,8α,9β,10α,12α)-

Molecular Formula

C20H30O2

Molecular Mass

302.45

Cite this Page

Atis-13-en-3-one, 16-hydroxy-, (5β,8α,9β,10α,12α)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=119642-81-8 (retrieved 2024-12-04) (CAS RN: 119642-81-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H30O2/c1-17(2)14-6-10-20-9-5-13(19(4,22)12-20)11-15(20)18(14,3)8-7-16(17)21/h5,9,13-15,22H,6-8,10-12H2,1-4H3/t13-,14+,15-,18+,19-,20+/m0/s1

InChIKey

InChIKey=AFZCVSRIUXFFJO-NJQZYEBPSA-N

SMILES

C[C@]12[C@]3([C@@]4(C[C@](C)(O)[C@](C3)(C=C4)[H])CC[C@@]1(C(C)(C)C(=O)CC2)[H])[H]

Canonical SMILES

O=C1CCC2(C)C(CCC34C=CC(CC32)C(O)(C)C4)C1(C)C

Other Names for this Substance

  • Atis-13-en-3-one, 16-hydroxy-, (5β,8α,9β,10α,12α)-
  • 7H-3,10a-Ethanophenanthrene, atis-13-en-3-one deriv.
  • Yucalexin A 16

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