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(3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(2R)-2-methyloxiran-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

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(3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(2R)-2-methyloxiran-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID K3mHMxMWX22
InChI InChI=1S/C22H34O2/c1-20-10-8-15(23)12-14(20)4-5-16-17-6-7-19(22(3)13-24-22)21(17,2)11-9-18(16)20/h4,15-19,23H,5-13H2,1-3H3/t15-,16-,17-,18-,19-,20-,21-,22-/m0/s1
InChIKey RUTUFQZITDCWGJ-JOFXYRRGSA-N
Mol Weight 330.5 g/mol
Molecular Formula C22H34O2
Exact Mass 330.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk1Iof4Byzn
Name (3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-[(2R)-2-methyloxiran-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Alternate Name(s) (3S,8S,9S,10R,13S,14S,17S)-10,13-dimethyl-17-((R)-2-methyloxiran-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H34O2
InChI InChI=1S/C22H34O2/c1-20-10-8-15(23)12-14(20)4-5-16-17-6-7-19(22(3)13-24-22)21(17,2)11-9-18(16)20/h4,15-19,23H,5-13H2,1-3H3/t15-,16-,17-,18-,19-,20-,21-,22-/m0/s1
InChIKey RUTUFQZITDCWGJ-JOFXYRRGSA-N
Molecular Weight 330.512 g/mol
SMILES O[C@@]1(CC=2[C@](CC1)([C@@]1([C@@](CC2)([C@]2([C@](CC1)([C@](CC2)([C@@]1(CO1)C)[H])C)[H])[H])[H])C)[H]
SPLASH splash10-01qa-0069000000-3c3f24b43c20df3852d0
Source of Spectrum SI-6-74-3a
Wiley ID 1813435