CHEBI:144306 - Succinprotocetraric acid

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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 Succinprotocetraric acid
ChEBI ID CHEBI:144306
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C22H18O12
Net Charge 0
Average Mass 474.372
Monoisotopic Mass 474.080
InChI InChI=1S/C22H18O12/c1-8-5-12(24)10(6-23)19-15(8)22(31)34-20-11(7-32-14(27)4-3-13(25)26)17(28)16(21(29)30)9(2)18(20)33-19/h5-6,24,28H,3-4,7H2,1-2H3,(H,25,26)(H,29,30)
InChIKey ROISWLBRDLJEFL-UHFFFAOYSA-N
SMILES O=C1OC2=C(C(=C(C(=O)O)C(=C2COC(=O)CCC(=O)O)O)C)OC3=C1C(=CC(=C3C=O)O)C
ChEBI Ontology
Outgoing Succinprotocetraric acid (CHEBI:144306) is a carbonyl compound (CHEBI:36586)