Namalide B

AlkaPlorer ID: AK341331

Synonym: None

IUPAC Name: 2-[[6-butan-2-yl-3-[2-(4-hydroxyphenyl)ethyl]-2,5,8-trioxo-1,4,7-triazacyclotridec-9-yl]carbamoylamino]-3-methylpentanoic acid

Structure

SMILES: CCC(C)C1N=C(O)C(N=C(O)NC(C(=O)O)C(C)CC)CCCCN=C(O)C(CCC2=CC=C(O)C=C2)N=C1O

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InChI: InChI=1S/C29H45N5O7/c1-5-17(3)23-27(38)31-22(15-12-19-10-13-20(35)14-11-19)25(36)30-16-8-7-9-21(26(37)33-23)32-29(41)34-24(28(39)40)18(4)6-2/h10-11,13-14,17-18,21-24,35H,5-9,12,15-16H2,1-4H3,(H,30,36)(H,31,38)(H,33,37)(H,39,40)(H2,32,34,41)

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InChIKey: BEGARHAEPVBWAE-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 575.7070000000004

TPSA: 199.92

MolLogP: 4.533000000000003

Number of H-Donors: 7

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information