(5Z)-25-{8-hydroxy-1H,2H,3H,4H,9H-pyrido[3,4-b]indol-1-yl}-11,22-diazapentacyclo[11.11.2.1²,²².0²,¹².0?,¹¹]heptacosa-5,16,25-trien-13-ol

AlkaPlorer ID: AK319686

Synonym: None

IUPAC Name: None

Structure

SMILES: OC1=CC=CC2=C1NC1=C2CCN[C@@H]1C1=C[C@@]2(O)CC/C=C\CCCCN3CC[C@@H]1[C@]1(C[C@@H]4C=CCCCCN4[C@H]12)C3

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InChI: InChI=1S/C36H48N4O2/c41-30-14-11-13-26-27-15-18-37-32(33(27)38-31(26)30)28-23-36(42)17-8-4-1-2-5-9-19-39-21-16-29(28)35(24-39)22-25-12-7-3-6-10-20-40(25)34(35)36/h1,4,7,11-14,23,25,29,32,34,37-38,41-42H,2-3,5-6,8-10,15-22,24H2/b4-1-,12-7?/t25-,29-,32+,34+,35-,36-/m0/s1

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InChIKey: SJELLHGOXQWTHX-BLVXENAXSA-N

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Reference

Properties Information

Molecule Weight: 568.8060000000003

TPSA: 74.75999999999999

MolLogP: 5.743000000000006

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information