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Methyl ester of (1R'-(1.alpha.,2.beta.,4a.beta.,4ba,8a.beta.,10 3a.alpha.))tetradecahydro-2-hydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthranecarboxylic acid
SpectraBase Compound ID 4a0fiXhR4Wl
InChI InChI=1S/C21H36O3/c1-18(2)10-7-11-19(3)14(18)8-12-20(4)15(19)9-13-21(5,23)16(20)17(22)24-6/h14-16,23H,7-13H2,1-6H3/t14-,15+,16-,19-,20+,21+/m0/s1
InChIKey BPSAVTNVJWAQMM-CLNCKLIYSA-N
Mol Weight 336.5 g/mol
Molecular Formula C21H36O3
Exact Mass 336.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Paek8Qwn4n
Name Methyl ester of (1R'-(1.alpha.,2.beta.,4a.beta.,4ba,8a.beta.,10 3a.alpha.))tetradecahydro-2-hydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthranecarboxylic acid
CAS Registry Number 72264-70-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O3
InChI InChI=1S/C21H36O3/c1-18(2)10-7-11-19(3)14(18)8-12-20(4)15(19)9-13-21(5,23)16(20)17(22)24-6/h14-16,23H,7-13H2,1-6H3/t14-,15+,16-,19-,20+,21+/m0/s1
InChIKey BPSAVTNVJWAQMM-CLNCKLIYSA-N
Molecular Weight 336.516 g/mol
SMILES O[C@]1([C@]([C@]2([C@@]([C@]3(CCCC([C@@]3(CC2)[H])(C)C)C)(CC1)[H])C)(C(=O)OC)[H])C
SPLASH splash10-0002-9501000000-d2d055909802f337b8e1
Source of Spectrum J-45-515-0
Synonyms Methyl (13beta,14beta)-13-hydroxy-8,13-dimethylpodocarpane-14-carboxylate Methyl ester of (1r'-(1.alpha.,2.beta.,4a.beta.,4ba,8a.beta.,10 3a.alpha.))tetradecahydro-2-ydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthranecarboxylic acid Tetradecahydro-2-hydroxy-2,4b,8,8,10a-pentamethyl-1-phenanthrene-carboxylic acid, methyl ester
Wiley ID 1332713