Products 116229-13-1

CAS 116229-13-1 is the registry number for Cyclodiol. Offered by: TRC, MedChemExpress. Available pack sizes: 100mg, Get quote.

Cyclodiol
TRC, MedChemExpress
  • size: 100mg, Get quote
  • Variants: 2
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Structural formula: {0} (CAS {1})

(2R,11S,14S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15-diol (CAS 116229-13-1) is a chemical compound with the molecular formula C20H26O2 and a molecular weight of 298.4 g/mol. IUPAC name: (2R,11S,14S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15-diol. InChIKey: YGXXZMDWSWSCSI-UYUJGIFYSA-N.

Identity
Molecular formulaC20H26O2
Molecular weight298.4 g/mol
IUPAC name(2R,11S,14S)-14-methylpentacyclo[13.2.2.01,14.02,11.05,10]nonadeca-5(10),6,8-triene-7,15-diol
InChIKeyYGXXZMDWSWSCSI-UYUJGIFYSA-N
SMILESC[C@]12CC[C@H]3[C@H](C14CCC2(CC4)O)CCC5=C3C=CC(=C5)O

Computed by PubChem (NCBI)

Synonyms: Cyclodiol, 14,21-Cyclo-19-norpregna-1,3,5(10)-triene-3,17-diol, Zk 115194, orb3174208, 14,21-Cyclo-19-norpregn-1,3,5(10)-triene-3,11-diol, (14xi,17xi)-14,21-Cyclo-19-norpregna-1(10),2,4-triene-3,17-diol
Isomers (same molecular formula)
1-butoxy-4-(4-butoxyphenyl)benzene C20H26O2
4-[2-(4-hydroxy-3,5-dimethylphenyl)butan-2-yl]-2,6-dimethylphenol C20H26O2
(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2
(13S,14S,17S)-13-ethyl-3-methoxy-6,7,11,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-ol C20H26O2
(8R,9S,10R,13S,14S,17S)-17-hydroxy-10,13-dimethyl-6-methylidene-8,9,11,12,14,15,16,17-octahydro-7H-cyclopenta[a]phenanthren-3-one C20H26O2
(8R,9S,10R,13S,14S)-10,13-dimethyl-6-methylidene-1,2,7,8,9,11,12,14,15,16-decahydrocyclopenta[a]phenanthrene-3,17-dione C20H26O2
(8S,9S,10R,14S)-13-ethyl-11-methylidene-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione C20H26O2
(8R,9S,10R,13S,14S,17S)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2
(8R,9S,13S,14S)-13-ethyl-3-methoxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one C20H26O2
(8R,9S,10R,13S,14S,17S)-10,13-dimethylspiro[2,8,9,11,12,14,15,16-octahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxirane]-3-one C20H26O2
(8R,9S,10R,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,4,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2
(8R,9R,10S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one C20H26O2