CHEBI:8341 - Portulacaxanthin II

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Portulacaxanthin II
ChEBI ID CHEBI:8341
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C18H18N2O7
C18H18N2O7
Net Charge 0
Average Mass 374.345
Monoisotopic Mass 374.11140
InChI InChI=1S/C18H18N2O7/c21-12-3-1-10(2-4-12)7-13(16(22)23)19-6-5-11-8-14(17(24)25)20-15(9-11)18(26)27/h1-6,8,13,15,20-21H,7,9H2,(H,22,23)(H,24,25)(H,26,27)/b11-5-,19-6-/t13-,15-/m0/s1
InChIKey MBFJCQLVRQZZOV-MRHCINOSSA-N
SMILES OC(=O)[C@H](Cc1ccc(O)cc1)\N=C/C=C1C[C@H](NC(=C\1)C(O)=O)C(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Portulacaxanthin II (CHEBI:8341) is a monocarboxylic acid (CHEBI:25384)
Synonyms Sources
(4E)-4-[(2E)-2-{[1-carboxy-2-(4-hydroxyphenyl)ethyl]imino}ethylidene]-1,2,3,4-tetrahydropyridine-2,6-dicarboxylic acid HMDB
Portulacaxanthin II KEGG COMPOUND
Tyrosine-betaxanthin HMDB
Manual Xrefs Databases
C00001604 KNApSAcK
C08565 KEGG COMPOUND
CPD-8670 MetaCyc
HMDB0012281 HMDB
View more database links
Registry Number Type Source
135545-98-1 CAS Registry Number KEGG COMPOUND
Citation Waiting for Citations Type Source
22624806 PubMed citation Europe PMC
Last Modified
23 October 2015