1-{[(4R,7S,10S,16S,19R)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-19-{[11-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)undecanoyl]amino}-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbon (57078-97-4)

Identification
Name:	1-{[(4R,7S,10S,16S,19R)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-19-{[11-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)undecanoyl]amino}-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbon
Synonyms:	1-{[(4r,7s,10s,16s,19r)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2s)-butan-2-yl]-19-{[11-(2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl)undecanoyl]amino}-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbonyl}prolyl-l-leucylglycinamide;OXMAC;AC1L4SJ7;KST-1B6748;AR-1B9562;1-(N-Maleoyl-11-aminoundecanoyl)cys-oxytocin;Oxytocin, 1-(N-maleoyl-11-aminoundecanoyl)cys-;Oxytocin, 1-(N-maleoyl-11-aminoundecanoyl)cysteine-;Oxytocin, N-(11-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)-1-oxoundecyl)-;N-[(2S)-1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[(4R,7S,10S,16S,19R)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-19-[11-(2,5-dioxopyrrol-1-yl)undecanoylamino]-16-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
CAS:	57078-97-4
Molecular Formula:	C₅₈H₈₇N₁₃O₁₅S₂
Molecular Weight:	1270.5195
InChI:	InChI=1/C58H87N13O15S2/c1-5-34(4)50-57(85)64-37(21-22-44(59)73)52(80)66-40(29-45(60)74)53(81)68-42(58(86)70-26-14-15-43(70)56(84)67-38(27-33(2)3)51(79)62-30-46(61)75)32-88-87-31-41(55(83)65-39(54(82)69-50)28-35-17-19-36(72)20-18-35)63-47(76)16-12-10-8-6-7-9-11-13-25-71-48(77)23-24-49(71)78/h17-20,23-24,33-34,37-43,50,72H,5-16,21-22,25-32H2,1-4H3,(H2,59,73)(H2,60,74)(H2,61,75)(H,62,79)(H,63,76)(H,64,85)(H,65,83)(H,66,80)(H,67,84)(H,68,81)(H,69,82)/t34-,37-,38-,39-,40-,41-,42-,43?,50?/m0/s1
Molecular Structure:
Properties
Flash Point:	942.1°C
Boiling Point:	1634.1°C at 760 mmHg
Density:	1.36g/cm³
Refractive index:	1.623
Flash Point:	942.1°C
Safety Data

1-{[(4R,7S,10S,16S,19R)-7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-[(2S)-butan-2-yl]-19-{[11-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)undecanoyl]amino}-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentaazacycloicosan-4-yl]carbon (57078-97-4)

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