CHEBI:138943 - carnosate

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name carnosate ChEBI ID CHEBI:138943 Definition A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of carnosic acid. The major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C20H27O4 Net Charge -1 Average Mass 331.427 Monoisotopic Mass 331.19148 InChI InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,4)8-5-9-20(14,18(23)24)15(12)17(22)16(13)21/h10-11,14,21-22H,5-9H2,1-4H3,(H,23,24)/p-1/t14-,20+/m0/s1 InChIKey QRYRORQUOLYVBU-VBKZILBWSA-M SMILES C1CC([C@]2([C@](C1)(C3=C(CC2)C=C(C(=C3O)O)C(C)C)C(=O)[O-])[H])(C)C ChEBI Ontology Outgoing carnosate (CHEBI:138943) is a abietane diterpenoid (CHEBI:36762) carnosate (CHEBI:138943) is a carbotricyclic compound (CHEBI:38032) carnosate (CHEBI:138943) is a monocarboxylic acid anion (CHEBI:35757) carnosate (CHEBI:138943) is conjugate base of carnosic acid (CHEBI:65585) Incoming carnosic acid (CHEBI:65585) is conjugate acid of carnosate (CHEBI:138943) IUPAC Name 11,12-dihydroxyabieta-8,11,13-trien-20-oate Synonyms Sources 11,12-dihydroxy-13-isopropylpodocarpa-8,11,13-trien-17-oate ChEBI carnosate UniProt Manual Xref Database CPD-18103 MetaCyc View more database links Citations Types Sources 26976595 PubMed citation SUBMITTER 27703160 PubMed citation SUBMITTER Last Modified 21 November 2017