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(3S,5R,7R,9R,10S,13R,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-7-methoxy-10,13-dimethyl-4-methylidene-1,2,3,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol

View entire compound with spectra: 1 NMR

(3S,5R,7R,9R,10S,13R,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-7-methoxy-10,13-dimethyl-4-methylidene-1,2,3,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
SpectraBase Compound ID 7QfKA2kzKjH
InChI InChI=1S/C30H50O2/c1-18(2)19(3)9-10-20(4)22-11-12-23-28-24(13-15-29(22,23)6)30(7)16-14-26(31)21(5)25(30)17-27(28)32-8/h18-20,22,24-27,31H,5,9-17H2,1-4,6-8H3/t19-,20-,22-,24+,25+,26+,27-,29-,30-/m1/s1
InChIKey CYDWXUDCTGPHJW-BKQUMLASSA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FkHR6BD62nX
Name (3S,5R,7R,9R,10S,13R,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-7-methoxy-10,13-dimethyl-4-methylidene-1,2,3,5,6,7,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-18(2)19(3)9-10-20(4)22-11-12-23-28-24(13-15-29(22,23)6)30(7)16-14-26(31)21(5)25(30)17-27(28)32-8/h18-20,22,24-27,31H,5,9-17H2,1-4,6-8H3/t19-,20-,22-,24+,25+,26+,27-,29-,30-/m1/s1
InChIKey CYDWXUDCTGPHJW-BKQUMLASSA-N
Literature Reference Author Y.SUGO,Y.INOUYE,N.NAKAYAMA
Literature Reference Citation STEROIDS,60,738(1995)
Literature Reference DOI 10.1016/0039-128x(95)00108-3
Molecular Weight 442.726 g/mol
Source File Reference UWLU73900