Parazoanthoxanthin A; 3,N6-Di-Me 

AlkaPlorer ID: AK100624

Synonym: Parazoanthoxanthin G

IUPAC Name: 5-N,2,13-trimethyl-4,6,11,13-tetrazatricyclo[8.3.0.03,7]trideca-1(10),2,4,6,8,11-hexaene-5,12-diamine

Structure

SMILES: CNC1=NC2=CC=C3N=C(N)N(C)C3=C(C)C2=N1

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InChI: InChI=1S/C12H14N6/c1-6-9-7(16-12(14-2)17-9)4-5-8-10(6)18(3)11(13)15-8/h4-5H,1-3H3,(H2,13,15)(H,14,16,17)

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InChIKey: QFFJUHOWKBSCKZ-UHFFFAOYSA-N

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Reference

PubChem CID: 162883245

SuperNatural Ⅲ: SN0303790

COCONUT: CNP0149268

Properties Information

Molecule Weight: 242.286

TPSA: 81.64999999999999

MolLogP: 1.4004199999999998

Number of H-Donors: 2

Number of H-Acceptors: 6

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information