CHEBI:174799 - Mammea B/BD

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Mammea B/BD
ChEBI ID CHEBI:174799
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H26O5
Net Charge 0
Average Mass 358.434
Monoisotopic Mass 358.17802
InChI InChI=1S/C21H26O5/c1-6-7-13-10-15(22)26-21-16(13)19(24)14(9-8-11(2)3)20(25)17(21)18(23)12(4)5/h8,10,12,24-25H,6-7,9H2,1-5H3
InChIKey FLFMHVIZGHIVEJ-UHFFFAOYSA-N
SMILES O1C2=C(C(CCC)=CC1=O)C(O)=C(C(O)=C2C(=O)C(C)C)CC=C(C)C
ChEBI Ontology
Outgoing Mammea B/BD (CHEBI:174799) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name
5,7-dihydroxy-6-(3-methylbut-2-enyl)-8-(2-methylpropanoyl)-4-propylchromen-2-one
Manual Xrefs Databases
30777041 ChemSpider
HMDB0034096 HMDB
View more database links