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1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,7,8,8a,9,10,10a-dodecahydro-9-hydroxy-1,4a,8-trimethyl-7-oxo-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,8.alpha.,8a.alpha.,9.alpha.,10a.alp ha.)]-
SpectraBase Compound ID DxypxhniRza
InChI InChI=1S/C19H28O4/c1-11-13(20)7-6-12-16(11)14(21)10-15-18(12,2)8-5-9-19(15,3)17(22)23-4/h6-7,11-12,14-16,21H,5,8-10H2,1-4H3/t11-,12-,14+,15?,16+,18+,19-/m0/s1
InChIKey MNKCWFOCMDSGSV-YVEBIHLLSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tjyok1dc11
Name 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,7,8,8a,9,10,10a-dodecahydro-9-hydroxy-1,4a,8-trimethyl-7-oxo-, methyl ester, [1R-(1.alpha.,4a.beta.,4b.alpha.,8.alpha.,8a.alpha.,9.alpha.,10a.alp ha.)]-
Alternate Name(s) Methyl (4alpha,7alpha,8alpha,14alpha)-7-hydroxy-14-methyl-13-oxopodocarp-11-en-15-oate Methyl 14.alpha.-methyl-13-oxo-7.alpha.-hydroxy-(8.alpha.H)-podocarp-11-en-18-oate
CAS Registry Number 109164-69-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-11-13(20)7-6-12-16(11)14(21)10-15-18(12,2)8-5-9-19(15,3)17(22)23-4/h6-7,11-12,14-16,21H,5,8-10H2,1-4H3/t11-,12-,14+,15?,16+,18+,19-/m0/s1
InChIKey MNKCWFOCMDSGSV-YVEBIHLLSA-N
Molecular Weight 320.429 g/mol
SMILES O[C@]1([C@]2([C@@]([C@@]3(C([C@](C(=O)OC)(C)CCC3)C1)C)(C=CC(=O)[C@@]2(C)[H])[H])[H])[H]
SPLASH splash10-0udi-0910000000-443d4baa750d00ea3310
Source of Spectrum KC-1989-1880-14
Wiley ID 1320285