(1S,9R,10S,16S)-16-methyl-4-[(1S,5S,9R,10S,16S)-16-methyl-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadec-2(7)-en-5-yl]-6,14-diazatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2(7),3,5-triene

AlkaPlorer ID: AK079156

Synonym: None

IUPAC Name: (1S,9R,10S,16S)-16-methyl-4-[(1S,5S,9R,10S,16S)-16-methyl-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadec-2(7)-en-5-yl]-6,14-diazatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene

Structure

SMILES: C[C@H]1C[C@@H]2CC3=C(CC[C@@H](C4=CC5=C(C[C@H]6C[C@H](C)C[C@@]57NCCC[C@@H]67)N=C4)N3)[C@@]3(C1)NCCC[C@@H]23

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InChI: InChI=1S/C32H46N4/c1-19-12-22-15-30-26(31(16-19)24(22)5-3-9-34-31)7-8-28(36-30)23-13-27-29(33-18-23)14-21-11-20(2)17-32(27)25(21)6-4-10-35-32/h13,18-22,24-25,28,34-36H,3-12,14-17H2,1-2H3/t19-,20-,21+,22+,24-,25-,28-,31-,32-/m0/s1

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InChIKey: JOBCREJXGBQGLZ-KTEXCLGESA-N

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Properties Information

Molecule Weight: 486.74800000000033

TPSA: 48.98

MolLogP: 5.745500000000004

Number of H-Donors: 3

Number of H-Acceptors: 4

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information