4-{2-[20-(3-Amino-1-hydroxy-3-oxopropyl)-9-[(10,12-dimethyltetradecanoyl)amino]-2,11,12,15-tetrahydroxy-6-(1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-23-yl]-1,2-dihydroxyethyl}phenyl β-alaninate hydrochloride (1:1)
Names
[ CAS No. ]:
138661-18-4
[ Name ]:
4-{2-[20-(3-Amino-1-hydroxy-3-oxopropyl)-9-[(10,12-dimethyltetradecanoyl)amino]-2,11,12,15-tetrahydroxy-6-(1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13,16]hexaazacyclohenicosin-23-yl]-1,2-dihydroxyethyl}phenyl β-alaninate hydrochloride (1:1)
[Synonym ]:
L-688,786 prodrug-8g
β-Alanine, 4-[2-[20-(3-amino-1-hydroxy-3-oxopropyl)-9-[(10,12-dimethyl-1-oxotetradecyl)amino]tetracosahydro-2,11,12,15-tetrahydroxy-6-(1-hydroxyethyl)-5,8,14,19,22,25-hexaoxo-1H-dipyrrolo[2,1-c:2', 1'-l][1,4,7,10,13,16]hexaazacycloheneicosin-23-yl]-1,2-dihydroxyethyl]phenyl ester, hydrochloride (1:1)
cyclic (6(R)1)-peptide,4-ester with b-alanine,monohydrochloride,trans
L-Proline,N-(10,12-dimethyl-1-oxotetradecyl)-(4R,5R)-4,5-dihydroxy-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4-(4-hydroxyphenyl)-L-threonyl-threo-3-hydroxy-L-glutaminyl-3-hydroxy-,cyclic (6y1)-peptide,4-ester with b-alanine,monohydrochloride,trans
4-{2-[20-(3-Amino-1-hydroxy-3-oxopropyl)-9-[(10,12-dimethyltetradecanoyl)amino]-2,11,12,15-tetrahydroxy-6-(1-hydroxyethyl)-5,8,14,19,22,25-hexaoxotetracosahydro-1H-dipyrrolo[2,1-c:2',1'-l][1,4,7,10,13 ;,16]hexaazacyclohenicosin-23-yl]-1,2-dihydroxyethyl}phenyl β-alaninate hydrochloride (1:1)
Chemical & Physical Properties
[ Boiling Point ]:
1464.7ºC at 760 mmHg
[ Molecular Formula ]:
C53H86ClN9O18
[ Molecular Weight ]:
1172.75000
[ Flash Point ]:
839.6ºC
[ Exact Mass ]:
1171.58000
[ PSA ]:
461.81000
[ LogP ]:
0.67900
[ Vapour Pressure ]:
0mmHg at 25°C