CHEBI:225646 - Benwamycin C

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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 Benwamycin C
ChEBI ID CHEBI:225646
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C18H24O5
Net Charge 0
Average Mass 320.385
Monoisotopic Mass 320.16237
InChI InChI=1S/C18H24O5/c1-11(13(3)20)18(22)12(2)17-8-7-16(23-14(4)21)10-15(17)6-5-9-19/h5-8,10-12,18-19,22H,9H2,1-4H3/b6-5+/t11-,12+,18+/m1/s1
InChIKey IAIBGPJIQSUBPG-BYHZGNBLSA-N
SMILES O=C(OC1=CC(=C([C@@H]([C@@H](O)[C@@H](C(=O)C)C)C)C=C1)/C=C/CO)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Benwamycin C (CHEBI:225646) is a benzoate ester (CHEBI:36054)
Benwamycin C (CHEBI:225646) is a phenols (CHEBI:33853)
IUPAC Name
[4-[(2S,3R,4S)-3-hydroxy-4-methyl-5-oxohexan-2-yl]-3-[(E)-3-hydroxyprop-1-enyl]phenyl] acetate