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)

Modify Date: 2024-02-01 13:40:10

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) structure	Common 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)
	CAS Number	138661-18-4	Molecular Weight	1172.75000
	Density	N/A	Boiling Point	1464.7ºC at 760 mmHg
	Molecular Formula	C₅₃H₈₆ClN₉O₁₈	Melting Point	N/A
	MSDS	N/A	Flash Point	839.6ºC

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	More Synonyms

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

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)

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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

Chemical & Physical Properties

Synonyms