SpectraBase Compound ID | Dq9LJuH4XIv |
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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 |
SpectraBase Spectrum ID | CboVOSWldkg |
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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 |