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14-Methoxyabieta-8,11,13-trien-18-oicacid
SpectraBase Compound ID BSEri4jHWCJ
InChI InChI=1S/C21H30O3/c1-13(2)14-7-9-16-15(18(14)24-5)8-10-17-20(16,3)11-6-12-21(17,4)19(22)23/h7,9,13,17H,6,8,10-12H2,1-5H3,(H,22,23)/t17-,20-,21-/m1/s1
InChIKey PBGGSUKJFJVSJR-DUXKGJEZSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID pd8k6IieRo
Name 14-Methoxyabieta-8,11,13-trien-18-oicacid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-13(2)14-7-9-16-15(18(14)24-5)8-10-17-20(16,3)11-6-12-21(17,4)19(22)23/h7,9,13,17H,6,8,10-12H2,1-5H3,(H,22,23)/t17-,20-,21-/m1/s1
InChIKey PBGGSUKJFJVSJR-DUXKGJEZSA-N
Molecular Weight 330.468 g/mol
SMILES OC([C@]1([C@]2([C@@](c3c(c(OC)c(cc3)C(C)C)CC2)(CCC1)C)[H])C)=O
SPLASH splash10-014i-0096000000-05fdfb15dd204676941c
Source of Spectrum F-66-5399-5
Synonyms (1R,4aS,10aR)-8-methoxy-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxylic acid
Wiley ID 1683772