Metabolomics Structure Database

 
MW REGNO: 66316
Common Name:Tatridin B
Systematic Name:(3aS*,4R*,5E,9R*,11aS*)-4,9-dihydroxy-6-methyl-3,10-bis(methylene)-3a,4,7,8,9,10,11,11a-octahydrocyclodeca[b]furan-2(3H)-one
Synonyms:(3aS*,4R*,5E,9R*,11aS*)-4,9-dihydroxy-6-methyl-3,10-dimethylidene-4,7,8,9,11,11a-hexahydro-3aH-cyclodeca[b]furan-2-one; 1beta-hydroxy-1-desoxotamirin; tatridin-B [PubChem Synonyms]
Exact Mass:
264.1362 (neutral)    Calculate m/z:
Formula:C15H20O4
InChIKey:KNEQPJSDSYNUHP-RFPYWGSLSA-N
ClassyFire superclass:Lipids and lipid-like molecules [C0000012]
SMILES:C/C/1=C[C@H]([C@@H]2C(=C)C(=O)O[C@H]2CC(=C)[C@@H](CC1)O)O
Studies:-

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External database links:

PubChem CID:14191260
CHEBI ID:73239

References

LIPID MAPS classification: "Update of the LIPID MAPS comprehensive classification system for lipids", Fahy E, Subramaniam S, Murphy RC, Nishijima M, Raetz CR, Shimizu T, Spener F, van Meer G, Wakelam MJ, and Dennis EA, J. Lipid Res. (2009) 50: S9-S14. DOI: 10.1194/jlr.R800095-JLR200
ClassyFire classification: "ClassyFire: automated chemical classification with a comprehensive, computable taxonomy", Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS, J. Cheminformatics (2016) 8:61. DOI: 10.1186/s13321-016-0174-y

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