Pigment A

AlkaPlorer ID: AK033356

Synonym: 'Pigment A'

IUPAC Name: 2,15,16,17-tetrahydroxy-6,18-dimethyl-8-propyl-19,21-dioxa-7-azapentacyclo[12.7.0.03,11.04,9.015,20]henicosa-1(14),2,4(9),5,7,11-hexaene-10,13-dione

Structure

SMILES: CCCC1=C2C(=O)C3=CC(=O)C4=C(OC5OC(C)C(O)C(O)C45O)C(=O)C3=C2C=C(C)N1

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InChI: InChI=1S/C23H23NO8/c1-4-5-12-15-10(6-8(2)24-12)14-11(18(15)27)7-13(25)16-20(19(14)28)32-22-23(16,30)21(29)17(26)9(3)31-22/h6-7,9,17,21-22,24,26,29-30H,4-5H2,1-3H3

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InChIKey: PBLXMLFSQXRIOJ-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 441.43600000000015

TPSA: 142.39

MolLogP: -0.0129

Number of H-Donors: 4

Number of H-Acceptors: 9

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information