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1-{[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-{4-[(bromoacetyl)amino]benzyl}-13-(butan-2-yl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}prolylleucylglycinamide (67651-40-5)

Identification
Name:1-{[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-{4-[(bromoacetyl)amino]benzyl}-13-(butan-2-yl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}prolylleucylglycinamide
Synonyms:1-{[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-{4-[(bromoacetyl)amino]benzyl}-13-(butan-2-yl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}prolylleucylglycinamide;OXBPD;AC1Q5JBO;AC1L4TA0;AR-1B9639;2-Bromoacetylamino-phe-deamino-oxytocin;Oxytocin, (bromoacetylamino-phe)(2)-deamino-;Oxytocin, (bromoacetylaminophenylalanine)(2)-deamino-;Oxytocin, 1-(3-mercaptopropanoic acid)-2-(4-((bromoacetyl)amino)-L-phenylalanine)-;N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-[[4-[(2-bromoacetyl)amino]phenyl]methyl]-13-butan-2-yl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
CAS:67651-40-5
Molecular Formula: C45H67BrN12O12S2
Molecular Weight: 1112.1207
InChI: InChI=1/C45H67BrN12O12S2/c1-5-24(4)38-44(69)53-27(12-13-33(47)59)40(65)54-30(19-34(48)60)41(66)56-31(45(70)58-15-6-7-32(58)43(68)55-28(17-23(2)3)39(64)50-21-35(49)61)22-72-71-16-14-36(62)52-29(42(67)57-38)18-25-8-10-26(11-9-25)51-37(63)20-46/h8-11,23-24,27-32,38H,5-7,12-22H2,1-4H3,(H2,47,59)(H2,48,60)(H2,49,61)(H,50,64)(H,51,63)(H,52,62)(H,53,69)(H,54,65)(H,55,68)(H,56,66)(H,57,67)
Molecular Structure: (C45H67BrN12O12S2) 1-{[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-16-{4-[(bromoacetyl)amino]benzyl}-13-(butan-2-yl...
Properties
Flash Point: 902.2°C
Boiling Point: 1568.2°C at 760 mmHg
Density:1.335g/cm3
Refractive index:1.563
Flash Point: 902.2°C
Safety Data
 

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