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19-Norkaur-16-ene-15-carboxylic acid, 3-hydroxy-, (3.beta.,4.beta.,15.alpha.)-
SpectraBase Compound ID I8oCUKBehgo
InChI InChI=1S/C20H30O3/c1-11-13-4-5-16-19(3)8-7-15(21)12(2)14(19)6-9-20(16,10-13)17(11)18(22)23/h12-17,21H,1,4-10H2,2-3H3,(H,22,23)/t12-,13-,14+,15+,16-,17+,19+,20+/m1/s1
InChIKey NSVXHMAAKYBRRN-BBJZCYOMSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bfalt4dj1q1
Name 19-Norkaur-16-ene-15-carboxylic acid, 3-hydroxy-, (3.beta.,4.beta.,15.alpha.)-
CAS Registry Number 76844-18-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-11-13-4-5-16-19(3)8-7-15(21)12(2)14(19)6-9-20(16,10-13)17(11)18(22)23/h12-17,21H,1,4-10H2,2-3H3,(H,22,23)/t12-,13-,14+,15+,16-,17+,19+,20+/m1/s1
InChIKey NSVXHMAAKYBRRN-BBJZCYOMSA-N
Molecular Weight 318.457 g/mol
SMILES O[C@]1(CC[C@@]2([C@@]3([C@]4([C@](C(=O)O)(C([C@](CC3)(C4)[H])=C)[H])CC[C@]2([C@]1(C)[H])[H])[H])C)[H]
SPLASH splash10-0udr-0089000000-a4d55567804f07b22945
Source of Spectrum B-33-2068-0
Synonyms (1S,4S,5R,6S,9S,10R,13R,15R)-6-hydroxy-5,9-dimethyl-14-methylenetetracyclo[11.2.1.0(1,10).0(4,9)]hexadecane-15-carboxylic acid (3.beta.,4.beta.,15.alpha.)-3-hydroxy-18-norkaur-16-ene-15-carboxylic acid 1H-2,10a-ethanophenanthrene, 19-norkaur-16-ene-15-carboxylic acid deriv.
Wiley ID 1318782