UNPD162407

AlkaPlorer ID: AK318939

Synonym: None

IUPAC Name: None

Structure

SMILES: C/C=C1/CN2CCC34C5=CC=CC=C5N5C=C6C7CC8N(CCC89C8=CC=CC=C8N(C=C(C1CC23)C54)C69)C/C7=C/C

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InChI: InChI=1S/C38H40N4/c1-3-23-19-39-15-13-37-29-9-5-8-12-32(29)42-22-28-26-18-34-38(14-16-40(34)20-24(26)4-2)30-10-6-7-11-31(30)41(36(28)38)21-27(35(37)42)25(23)17-33(37)39/h3-12,21-22,25-26,33-36H,13-20H2,1-2H3/b23-3-,24-4-,27-21?,28-22?

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InChIKey: XISKMNBBUQQBBE-GNQOHBJNSA-N

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Reference

Properties Information

Molecule Weight: 552.7660000000002

TPSA: 12.96

MolLogP: 6.129200000000007

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 11

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information