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c(phg-isoDGR-(NMe)k)
[CAS# 1844830-65-4]

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Identification
Name c(phg-isoDGR-(NMe)k)
Synonyms (5S,8R,11R,14S)-8-(4-aminobutyl)-5-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,16-pentaoxo-11-phenyl-1,4,7,10,13-pentazacyclohexadecane-14-carboxylic acid
Molecular Structure CAS # 1844830-65-4, c(phg-isoDGR-(NMe)k), (5S,8R,11R,14S)-8-(4-aminobutyl)-5-[3-(diaminomethylideneamino)propyl]-7-methyl-3,6,9,12,16-pentaoxo-11-phenyl-1,4,7,10,13-pentazacyclohexadecane-14-carboxylic acid
Molecular Formula C27H41N9O7
Molecular Weight 603.67
CAS Registry Number 1844830-65-4
SMILES CN1[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](CC(=O)NCC(=O)N[C@H](C1=O)CCCN=C(N)N)C(=O)O)C2=CC=CC=C2)CCCCN
Properties
Density 1.5±0.1 g/cm3, Calc.*
Index of Refraction 1.659, Calc.*
* Calculated using Advanced Chemistry Development (ACD/Labs) Software.
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