CHEBI:203155 - Talapolyester E

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Talapolyester E
ChEBI ID CHEBI:203155
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C34H40O16
Net Charge 0
Average Mass 704.678
Monoisotopic Mass 704.23164
InChI InChI=1S/C34H40O16/c1-16-6-21-10-23(36)12-26(38)31(21)34(44)49-19(4)9-29(41)50-25(15-45-20(5)35)14-30(42)47-17(2)7-22-11-24(37)13-27(39)32(22)33(43)48-18(3)8-28(40)46-16/h10-13,16-19,25,36-39H,6-9,14-15H2,1-5H3/t16-,17-,18+,19-,25-/m1/s1
InChIKey AWIDVOUTUFMVPQ-SYEQPEDASA-N
SMILES O=C1O[C@@H](CC(=O)O[C@H](CC(=O)O[C@@H](CC=2C=C(O)C=C(C2C(O[C@H](CC(O[C@@H](CC=3C1=C(O)C=C(O)C3)C)=O)C)=O)O)C)COC(=O)C)C
Metabolite of Species Details
Talaromyces (NCBI:txid5094) See: DOI
ChEBI Ontology
Outgoing Talapolyester E (CHEBI:203155) has functional parent pentacarboxylic acid (CHEBI:35743)
Talapolyester E (CHEBI:203155) is a organooxygen compound (CHEBI:36963)
IUPAC Name
[(4S,8R,18R,22R,26R)-12,14,30,32-tetrahydroxy-4,8,18,26-tetramethyl-2,6,16,20,24-pentaoxo-3,7,17,21,25-pentaoxatricyclo[26.4.0.010,15]dotriaconta-1(28),10(15),11,13,29,31-hexaen-22-yl]methyl acetate