(1S,5R,6R)-6-methyl-5-[(1S,5R,6R)-6-methyl-2,8-dioxo-9-azatricyclo[7.4.3.0⁴,¹³]hexadec-4(13)-en-5-yl]-9-azatricyclo[7.4.3.0⁴,¹³]hexadec-4(13)-ene-2,8-dione

AlkaPlorer ID: AK319158

Synonym: None

IUPAC Name: 6-methyl-5-(6-methyl-2,8-dioxo-9-azatricyclo[7.4.3.04,13]hexadec-4(13)-en-5-yl)-9-azatricyclo[7.4.3.04,13]hexadec-4(13)-ene-2,8-dione

Structure

SMILES: CC1CC(=O)N2CCCC3=C(CC(=O)C3CCC2)C1C1C2=C3CCCN(CCCC3C(=O)C2)C(=O)CC1C

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InChI: InChI=1S/C32H44N2O4/c1-19-15-29(37)33-11-3-7-21-23(9-5-13-33)27(35)17-25(21)31(19)32-20(2)16-30(38)34-12-4-8-22-24(10-6-14-34)28(36)18-26(22)32/h19-20,23-24,31-32H,3-18H2,1-2H3

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InChIKey: NKORDQHTEAGHPH-UHFFFAOYSA-N

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Reference

PubChem CID: 5320531

NPASS: NPC214852

COCONUT: CNP0421712.1

Source

Properties Information

Molecule Weight: 520.7140000000004

TPSA: 74.76

MolLogP: 4.874800000000005

Number of H-Donors: 0

Number of H-Acceptors: 4

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information