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12-Desoxy-6-hydroxy-7-oxopodocarpa-7,8,11,13-tetraene-5-carboxylic acid
SpectraBase Compound ID 3QoHxNK1L02
InChI InChI=1S/C17H18O4/c1-16-8-5-9-17(2,15(20)21)14(16)13(19)12(18)10-6-3-4-7-11(10)16/h3-4,6-7,19H,5,8-9H2,1-2H3,(H,20,21)/t16-,17+/m1/s1
InChIKey RQPCBDUERBLCEM-SJORKVTESA-N
Mol Weight 286.33 g/mol
Molecular Formula C17H18O4
Exact Mass 286.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ieiS0ZYSMe
Name 12-Desoxy-6-hydroxy-7-oxopodocarpa-7,8,11,13-tetraene-5-carboxylic acid
Alternate Name(s) (1S,4aR)-10-hydroxy-1,4a-dimethyl-9-oxo-3,4-dihydro-2H-phenanthrene-1-carboxylic acid (1S,4aR)-1,4a-dimethyl-10-oxidanyl-9-oxidanylidene-3,4-dihydro-2H-phenanthrene-1-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O4
InChI InChI=1S/C17H18O4/c1-16-8-5-9-17(2,15(20)21)14(16)13(19)12(18)10-6-3-4-7-11(10)16/h3-4,6-7,19H,5,8-9H2,1-2H3,(H,20,21)/t16-,17+/m1/s1
InChIKey RQPCBDUERBLCEM-SJORKVTESA-N
Molecular Weight 286.327 g/mol
SMILES OC=1C(c2ccccc2[C@@]2(C1[C@@](C(=O)O)(CCC2)C)C)=O
SPLASH splash10-017i-0950000000-26278f5acdd17e07c6bf
Source of Spectrum SK-26-4588-17
Wiley ID 867495