Ikarugamycin; 25S-Hydroxy 

AlkaPlorer ID: AK302321

Synonym: Butremycin

IUPAC Name: 11-ethyl-2,24-dihydroxy-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,13,18-tetraene-20,27,28-trione

Structure

SMILES: CCC1C(C)CC2C1C=CC1C3CC=CC(=O)NCCC(O)C4NC(=O)C(=C4O)C(=O)C=CC3CC12

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InChI: InChI=1S/C29H38N2O5/c1-3-17-15(2)13-21-19(17)8-9-20-18-5-4-6-25(34)30-12-11-24(33)27-28(35)26(29(36)31-27)23(32)10-7-16(18)14-22(20)21/h4,6-10,15-22,24,27,33,35H,3,5,11-14H2,1-2H3,(H,30,34)(H,31,36)

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InChIKey: IJOMIIDEKGZJJF-UHFFFAOYSA-N

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Reference

COCONUT: CNP0168405.2

Properties Information

Molecule Weight: 494.6320000000003

TPSA: 115.73000000000002

MolLogP: 2.9860000000000007

Number of H-Donors: 4

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information