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1-Phenanthrenecarboxylic acid, 7-(diethoxyphosphinyl)-1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-d imethyl-, methyl ester, [1S-(1.alpha.,4a.alpha.,10a.beta.)]-
SpectraBase Compound ID E1TaZZCL0bD
InChI InChI=1S/C22H33O6P/c1-6-27-29(25,28-7-2)18-13-15-9-10-19-21(3,16(15)14-17(18)23)11-8-12-22(19,4)20(24)26-5/h13-14,19,23H,6-12H2,1-5H3/t19-,21-,22+/m1/s1
InChIKey ZPLQJABBBZTLRK-FCEUIQTBSA-N
Mol Weight 424.5 g/mol
Molecular Formula C22H33O6P
Exact Mass 424.201476 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bupgp6rE4W
Name 1-Phenanthrenecarboxylic acid, 7-(diethoxyphosphinyl)-1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-d imethyl-, methyl ester, [1S-(1.alpha.,4a.alpha.,10a.beta.)]-
Alternate Name(s) Methyl (4alpha)-13-(diethoxyphosphoryl)-12-hydroxypodocarpa-8,11,13-trien-15-oate Methyl ester of 13-diethoxyphosphoryl-12-hydroxypodocarpa-8,11,13-trien-19-oic acid
CAS Registry Number 83117-51-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H33O6P
InChI InChI=1S/C22H33O6P/c1-6-27-29(25,28-7-2)18-13-15-9-10-19-21(3,16(15)14-17(18)23)11-8-12-22(19,4)20(24)26-5/h13-14,19,23H,6-12H2,1-5H3/t19-,21-,22+/m1/s1
InChIKey ZPLQJABBBZTLRK-FCEUIQTBSA-N
Molecular Weight 424.474 g/mol
SMILES Oc1c(P(=O)(OCC)OCC)cc2CC[C@@]3([C@@](c2c1)(CCC[C@@]3(C(=O)OC)C)C)[H]
SPLASH splash10-00fu-5923400000-088b2ef7f514844928ed
Source of Spectrum B-35-835-0
Wiley ID 1379238