Indicaxanthin

AlkaPlorer ID: AK302424

Synonym: 4-[2-(2-Carboxy-1-pyrrolidinyl)ethenyl]-2,3-dihydro-2,6-pyridinedicarboxylic acid

IUPAC Name: 1-[2-(2,6-dicarboxy-2,3-dihydro-1H-pyridin-4-ylidene)ethylidene]pyrrolidin-1-ium-2-carboxylate

Structure

SMILES: O=C(O)C1=CC(=CC=[N+]2CCCC2C(=O)[O-])CC(C(=O)O)N1

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InChI: InChI=1S/C14H16N2O6/c17-12(18)9-6-8(7-10(15-9)13(19)20)3-5-16-4-1-2-11(16)14(21)22/h3,5-6,10-11H,1-2,4,7H2,(H3,17,18,19,20,21,22)

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InChIKey: RJIIQBYZGJSODH-UHFFFAOYSA-N

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Reference

PubChem CID: 4480892

CAS: 2181-75-1

COCONUT: CNP0085440.3

Properties Information

Molecule Weight: 308.29

TPSA: 129.76999999999998

MolLogP: -1.676599999999996

Number of H-Donors: 3

Number of H-Acceptors: 5

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information