(4aS,4bR,10bS,12aS)-3,4,4a,4b,5,6,10b,11,12,12a-Decahydro-8-hydroxy-12a-methyl-2H-phenanthro[2,1-b]pyran-2-one

CAS Registry Number®

604-82-0
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CAS Name

(4aS,4bR,10bS,12aS)-3,4,4a,4b,5,6,10b,11,12,12a-Decahydro-8-hydroxy-12a-methyl-2H-phenanthro[2,1-b]pyran-2-one

Molecular Formula

C18H22O3

Molecular Mass

286.37

Cite this Page

(4aS,4bR,10bS,12aS)-3,4,4a,4b,5,6,10b,11,12,12a-Decahydro-8-hydroxy-12a-methyl-2H-phenanthro[2,1-b]pyran-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=604-82-0 (retrieved 2024-05-19) (CAS RN: 604-82-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    339 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H22O3/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(20)21-18/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1

InChIKey

InChIKey=FWJIMKYKNBCAJA-CBZIJGRNSA-N

SMILES

C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O)=CC4)(CC1)[H])[H])(CCC(=O)O2)[H]

Canonical SMILES

O=C1OC2(C)CCC3C4=CC=C(O)C=C4CCC3C2CC1

Other Names for this Substance

  • 2H-Phenanthro[2,1-b]pyran-2-one, 3,4,4a,4b,5,6,10b,11,12,12a-decahydro-8-hydroxy-12a-methyl-, (4aS,4bR,10bS,12aS)-
  • 13,17-Secoestra-1,3,5(10)-trien-17-oic acid, 3,13-dihydroxy-, δ-lactone
  • D-Homo-17a-oxaestra-1,3,5(10)-trien-17-one, 3-hydroxy-
  • 1-Phenanthrenepropionic acid, 1,2,3,4,4a,9,10,10a-octahydro-2,7-dihydroxy-2-methyl-, δ-lactone
  • (4aS,4bR,10bS,12aS)-3,4,4a,4b,5,6,10b,11,12,12a-Decahydro-8-hydroxy-12a-methyl-2H-phenanthro[2,1-b]pyran-2-one

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