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17-(4-ethyl-1,5-dimethyl-hex-5-enyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol

View entire compound with spectra: 1 MS (GC)

17-(4-ethyl-1,5-dimethyl-hex-5-enyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID HcwyMNGx6kl
InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,20-21,23-27,30H,2,7-9,11-18H2,1,3-6H3
InChIKey GHGKPLPBPGYSOO-UHFFFAOYSA-N
Mol Weight 412.7 g/mol
Molecular Formula C29H48O
Exact Mass 412.370516 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vLRDAUNcW
Name 17-(4-ethyl-1,5-dimethyl-hex-5-enyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Alternate Name(s) 17-(5-ethyl-6-methyl-hept-6-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol Clerosterol NSC 144945
CAS Registry Number 2364-23-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H48O
InChI InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,20-21,23-27,30H,2,7-9,11-18H2,1,3-6H3
InChIKey GHGKPLPBPGYSOO-UHFFFAOYSA-N
Molecular Weight 412.702 g/mol
SMILES OC1CC=2C(C3C(C4C(C)(CC3)C(CC4)C(CCC(C(C)=C)CC)C)CC2)(C)CC1
SPLASH splash10-03di-0092200000-e72ac43fc5d6e91b0cf8
Source of Spectrum J-50-2030-16
Wiley ID 1374796