Octa-valinomycin structure

Octa-valinomycin

6,18-dimethyl-3,9,12,15,21,24-hexa(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone

Also Known As: Octa-valinomycin|Montanastatin|Valinomicin|Octa-meso valinomycin|Cyclo(val-hyi-val-hyi)2|Montanastatin (9CI)|Cyclo(valyl-hydroxyisovaleryl-valyl-hydroxyisovaleryl)2|6,18-dimethyl-3,9,12,15,21,24-hexa(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosane-2,5,8,11,14,17,20,23-octone|6,18-dimethyl-3,9,12,15,21,24-hexa(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone|5,11,17,23-Tetrahydroxy-6,18-dimethyl-3,9,12,15,21,24-hexa(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetraazacyclotetracosa-4,10,16,22-tetraene-2,8,14,20-tetrone|Valinomycin, 9-de(D-2-hydroxy-3-methylbutanoic acid)-10-de-D-valine-11-de(L-2-hydroxypropanoic acid)-12-de-L-valine-

CAS: 1706-26-9
Molecular Formula C36H60N4O12
Molecular Weight 740.4208 g/mol
LogP 6.1
Topological Polar Surface Area 222.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 12
Rotatable Bonds 6
Exact Mass 740.4208
Monoisotopic Mass 740.4208
Heavy Atoms 52
Complexity 1210.0

Chemical Identifiers

CAS Number 1706-26-9
SMILES CC1C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C(=O)NC(C(=O)OC(C(=O)NC(C(=O)O1)C(C)C)C(C)C)C(C)C)C)C(C)C)C(C)C)C(C)C
InChIKey NGUGHCRMWIKICS-UHFFFAOYSA-N

Product Overview

Octa-valinomycin (CAS 1706-26-9), with molecular formula C36H60N4O12 and molecular weight 740.4208 g/mol. IUPAC: 6,18-dimethyl-3,9,12,15,21,24-hexa(propan-2-yl)-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone.

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