CHEBI:226424 - Pteridic acid E

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ChEBI Name Pteridic acid E
ChEBI ID CHEBI:226424
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H32O6
Net Charge 0
Average Mass 368.470
Monoisotopic Mass 368.21989
InChI InChI=1S/C20H32O6/c1-11(8-6-7-9-17(22)23)19-13(3)18(24)14(4)20(26-19)10-16(21)12(2)15(5)25-20/h6-9,11-16,18-19,21,24H,10H2,1-5H3,(H,22,23)/b8-6+,9-7+/t11-,12+,13-,14-,15+,16+,18+,19-,20-/m0/s1
InChIKey GYTVZXLCIFKWMV-QKDYPMQGSA-N
SMILES O=C(O)/C=C/C=C/[C@@H]([C@@H]1O[C@]2(O[C@@H]([C@@H](C)[C@@H](C2)O)C)[C@@H](C)[C@@H]([C@@H]1C)O)C
Metabolite of Species Details
Streptomycesspecies SCSGAA 0027 (NCBI:txid2979574) See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Pteridic acid E (CHEBI:226424) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name
(2E,4E,6S)-6-[(2S,3S,4R,5S,6S,8R,9S,10R)-4,10-dihydroxy-3,5,8,9-tetramethyl-1,7-dioxaspiro[5.5]undecan-2-yl]hepta-2,4-dienoic acid
Manual Xref Database
62277911 ChemSpider
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