CHEBI:144235 - Thamnolic acid

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 Thamnolic acid
ChEBI ID CHEBI:144235
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C19H16O11
Net Charge 0
Average Mass 420.324
Monoisotopic Mass 420.069
InChI InChI=1S/C19H16O11/c1-6-4-9(29-3)12(18(26)27)15(23)10(6)19(28)30-16-7(2)11(17(24)25)13(21)8(5-20)14(16)22/h4-5,21-23H,1-3H3,(H,24,25)(H,26,27)
InChIKey RNCJCRJLNVRWJX-UHFFFAOYSA-N
SMILES O=C(OC1=C(O)C(=C(O)C(=C1C)C(=O)O)C=O)C2=C(O)C(=C(OC)C=C2C)C(=O)O
ChEBI Ontology
Outgoing Thamnolic acid (CHEBI:144235) is a carbonyl compound (CHEBI:36586)