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15-METHOXY-PINUSOLIDIC-ACID;15-METHOXY-8(17),13-LABDADIEN-16,15-OLIDE-19-OIC-ACID
SpectraBase Compound ID Dq9LJuH4XIv
InChI InChI=1S/C21H30O5/c1-13-6-9-16-20(2,10-5-11-21(16,3)19(23)24)15(13)8-7-14-12-17(25-4)26-18(14)22/h12,15-17H,1,5-11H2,2-4H3,(H,23,24)/t15-,16-,17?,20-,21+/m1/s1
InChIKey OREKSZUASHFFQA-MZGGREPNSA-N
Mol Weight 362.47 g/mol
Molecular Formula C21H30O5
Exact Mass 362.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CboVOSWldkg
Name 15-Methoxy-8(17),13-labdadien-16,15-olide-19-oic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O5
InChI InChI=1S/C21H30O5/c1-13-6-9-16-20(2,10-5-11-21(16,3)19(23)24)15(13)8-7-14-12-17(25-4)26-18(14)22/h12,15-17H,1,5-11H2,2-4H3,(H,23,24)/t15-,16-,17?,20-,21+/m1/s1
InChIKey OREKSZUASHFFQA-MZGGREPNSA-N
Molecular Weight 362.466 g/mol
SMILES OC([C@@]1([C@]2([C@@]([C@@](C(CC2)=C)(CCC=2C(OC(C2)OC)=O)[H])(CCC1)C)[H])C)=O
SPLASH splash10-004s-5921000000-1681ffb96f82844caf94
Source of Spectrum E2-50-836-1
Synonyms (1S,4aR,5R,8aR)-5-[2-(2-methoxy-5-oxo-2H-furan-4-yl)ethyl]-1,4a-dimethyl-6-methylene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (1S,4aR,5R,8aR)-5-[2-(2-methoxy-5-oxo-2H-furan-4-yl)ethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid (1S,4aR,5R,8aR)-5-[2-(2-methoxy-5-oxo-2H-furan-4-yl)ethyl]-1,4a-dimethyl-6-methylene-decalin-1-carboxylic acid (1S,4aR,5R,8aR)-5-[2-(2-methoxy-5-oxidanylidene-2H-furan-4-yl)ethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Wiley ID 1555863