CHEBI:197567 - Talapolyester C

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ChEBI Name Talapolyester C
ChEBI ID CHEBI:197567
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H32O12
Net Charge 0
Average Mass 500.497
Monoisotopic Mass 500.18938
InChI InChI=1S/C23H32O12/c1-12(33-20(29)7-13(2)34-21(30)10-17(26)11-24)5-15-8-16(25)9-18(27)22(15)23(31)35-14(3)6-19(28)32-4/h8-9,12-14,17,24-27H,5-7,10-11H2,1-4H3/t12-,13-,14+,17-/m1/s1
InChIKey COTGXQLEZUUFKB-VWPFQQQWSA-N
SMILES O=C(O[C@H](CC(=O)OC)C)C1=C(O)C=C(O)C=C1C[C@H](OC(=O)C[C@H](OC(=O)C[C@@H](O)CO)C)C
Metabolite of Species Details
Talaromyces (NCBI:txid5094) See: DOI
ChEBI Ontology
Outgoing Talapolyester C (CHEBI:197567) has functional parent tetracarboxylic acid (CHEBI:35742)
Talapolyester C (CHEBI:197567) is a organooxygen compound (CHEBI:36963)
IUPAC Name
[(2S)-4-methoxy-4-oxobutan-2-yl] 2-[(2R)-2-[(3R)-3-[(3R)-3,4-dihydroxybutanoyl]oxybutanoyl]oxypropyl]-4,6-dihydroxybenzoate