CHEBI:174730 - 6alpha-Hydroxyisomedicarpin

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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 6alpha-Hydroxyisomedicarpin
ChEBI ID CHEBI:174730
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C16H14O5
Net Charge 0
Average Mass 286.283
Monoisotopic Mass 286.08412
InChI InChI=1S/C16H14O5/c1-19-10-3-4-11-13(7-10)20-8-16(18)12-5-2-9(17)6-14(12)21-15(11)16/h2-7,15,17-18H,8H2,1H3
InChIKey MENGTHFLVHDIFW-UHFFFAOYSA-N
SMILES O1C2C(O)(C3=C1C=C(O)C=C3)COC4=C2C=CC(OC)=C4
ChEBI Ontology
Outgoing 6alpha-Hydroxyisomedicarpin (CHEBI:174730) is a pterocarpans (CHEBI:26377)
IUPAC Name
3-methoxy-6,11a-dihydro-[1]benzouro[3,2-c]chromene-6a,9-diol
Manual Xrefs Databases
24843050 ChemSpider
HMDB0034114 HMDB
LMPK12070132 LIPID MAPS
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