CHEBI:172519 - Melilotocarpan B

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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 Melilotocarpan B
ChEBI ID CHEBI:172519
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 C16H14O5
Net Charge 0
Average Mass 286.283
Monoisotopic Mass 286.08412
InChI InChI=1S/C16H14O5/c1-19-12-5-4-10-15-11(7-20-16(10)14(12)18)9-3-2-8(17)6-13(9)21-15/h2-6,11,15,17-18H,7H2,1H3
InChIKey QDFJNOVWEADTGJ-UHFFFAOYSA-N
SMILES O1C2C(C3=C1C=C(O)C=C3)COC4=C2C=CC(OC)=C4O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing Melilotocarpan B (CHEBI:172519) is a pterocarpans (CHEBI:26377)
IUPAC Name
3-methoxy-6a,11a-dihydro-6H-[1]benzouro[3,2-c]chromene-4,9-diol
Manual Xrefs Databases
24843017 ChemSpider
HMDB0029527 HMDB
LMPK12070077 LIPID MAPS
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