CHEBI:214333 - Coumabiocin F

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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 Coumabiocin F
ChEBI ID CHEBI:214333
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H21NO7
Net Charge 0
Average Mass 411.410
Monoisotopic Mass 411.13180
InChI InChI=1S/C22H21NO7/c1-10(2)17(26)9-13-8-12(4-6-16(13)25)21(28)23-18-19(27)14-5-7-15(24)11(3)20(14)30-22(18)29/h4-8,17,24-27H,1,9H2,2-3H3,(H,23,28)/t17-/m0/s1
InChIKey NMJKLLUCHZDXRI-KRWDZBQOSA-N
SMILES O=C1OC2=C(C=CC(=C2C)O)C(=C1NC(=O)C3=CC(=C(O)C=C3)C[C@H](O)C(=C)C)O
Metabolite of Species Details
Streptomycesspecies L-4-4 (NCBI:txid756412) See: PubMed
ChEBI Ontology
Outgoing Coumabiocin F (CHEBI:214333) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name
N-(4,7-dihydroxy-8-methyl-2-oxochromen-3-yl)-4-hydroxy-3-[(2S)-2-hydroxy-3-methylbut-3-enyl]benzamide
Manual Xref Database
78439728 ChemSpider
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