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1-Phenanthrenecarboxylic acid, 5-amino-7-ethyl-1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethyl-, methyl ester, [1S-(1.alpha.,4a.alpha.,10a.beta.)]-
SpectraBase Compound ID JIhHoo8fD8c
InChI InChI=1S/C20H29NO3/c1-5-12-11-13-7-8-14-19(2,15(13)16(21)17(12)22)9-6-10-20(14,3)18(23)24-4/h11,14,22H,5-10,21H2,1-4H3/t14-,19+,20+/m1/s1
InChIKey HSVHGUSSIBHCRZ-UAOJZALGSA-N
Mol Weight 331.46 g/mol
Molecular Formula C20H29NO3
Exact Mass 331.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B47PVuXpfVY
Name 1-Phenanthrenecarboxylic acid, 5-amino-7-ethyl-1,2,3,4,4a,9,10,10a-octahydro-6-hydroxy-1,4a-dimethyl-, methyl ester, [1S-(1.alpha.,4a.alpha.,10a.beta.)]-
Alternate Name(s) Methyl (4alpha)-11-amino-13-ethyl-12-hydroxypodocarpa-8,11,13-trien-15-oate Methyl 11-amino-13-ethyl-12-hydroxypodocarpa-8,11,13-trien-19-oate
CAS Registry Number 128736-97-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H29NO3
InChI InChI=1S/C20H29NO3/c1-5-12-11-13-7-8-14-19(2,15(13)16(21)17(12)22)9-6-10-20(14,3)18(23)24-4/h11,14,22H,5-10,21H2,1-4H3/t14-,19+,20+/m1/s1
InChIKey HSVHGUSSIBHCRZ-UAOJZALGSA-N
Molecular Weight 331.456 g/mol
SMILES Oc1c(cc2CC[C@@]3([C@@](c2c1N)(CCC[C@@]3(C(=O)OC)C)C)[H])CC
SPLASH splash10-0fai-0059000000-7b4d77978a635378f03c
Source of Spectrum B-43-500-34
Wiley ID 1328822