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L-Aspartamide,N5-(aminocarbonyl)-N2-[(2Z)-1-oxo-2-decenyl]-D-ornithyl-L-seryl-N4-L-allothreonyl-(2S)-2,4-diaminobutanoyl-N1-[(1S)-3-amino-1-(hydroxymethyl)-3-oxopropyl]-3-hydroxy-,(3S)- (9CI) (142689-34-7)

Identification
Name:L-Aspartamide,N5-(aminocarbonyl)-N2-[(2Z)-1-oxo-2-decenyl]-D-ornithyl-L-seryl-N4-L-allothreonyl-(2S)-2,4-diaminobutanoyl-N1-[(1S)-3-amino-1-(hydroxymethyl)-3-oxopropyl]-3-hydroxy-,(3S)- (9CI)
Synonyms:L-Aspartamide,N5-(aminocarbonyl)-N2-(1-oxo-2-decenyl)-D-ornithyl-L-seryl-N4-L-allothreonyl-L-2,4-diaminobutanoyl-N1-[3-amino-1-(hydroxymethyl)-3-oxopropyl]-3-hydroxy-,[1(Z),4[threo-(S)]]-; AJI 302; Rotihibin A
CAS:142689-34-7
Molecular Formula: C35H63 N11 O13
Molecular Weight: 845.9406
InChI: InChI=1/C35H63N11O13/c1-3-4-5-6-7-8-9-12-25(51)43-22(11-10-14-42-35(40)59)30(54)44-23(18-48)31(55)45-27(28(52)29(39)53)34(58)46(20(17-47)16-24(37)50)33(57)21(36)13-15-41-32(56)26(38)19(2)49/h9,12,19-23,26-28,47-49,52H,3-8,10-11,13-18,36,38H2,1-2H3,(H2,37,50)(H2,39,53)(H,41,56)(H,43,51)(H,44,54)(H,45,55)(H3,40,42,59)/b12-9-/t19-,20-,21?,22+,23-,26-,27-,28-/m0/s1
Molecular Structure: (C35H63N11O13) L-Aspartamide,N5-(aminocarbonyl)-N2-(1-oxo-2-decenyl)-D-ornithyl-L-seryl-N4-L-allothreonyl-L-2,4-dia...
Properties
Flash Point: 751.6°C
Boiling Point: 1319.1°Cat760mmHg
Density:1.328g/cm3
Refractive index:1.572
Flash Point: 751.6°C
Safety Data
 

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