CAS No. 386253-60-7

 

Product Information

Chemical Formula:C27H36N8O5•2C2H4O2
Molecular Weight:672.73
Synonyms:H-D-Phe-Pip-Arg-pNA diacetate; H-D-Phe-L-pipecolyl-Arg-pNA diacetate
MDL No.:MFCD02259651
EINECS / EC No.:N/A
Pubchem CID:145707419
IUPAC Name:acetic acid; 1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(2S)-5-(diaminomethylideneamino)-1-(4-nitroanilino)-1-oxopentan-2-yl]piperidine-2-carboxamide
Standard InchI:InChI=1S/C27H36N8O5.2C2H4O2/c28-21(17-18-7-2-1-3-8-18)26(38)34-16-5-4-10-23(34)25(37)33-22(9-6-15-31-27(29)30)24(36)32-19-11-13-20(14-12-19)35(39)40;2*1-2(3)4/h1-3,7-8,11-14,21-23H,4-6,9-10,15-17,28H2,(H,32,36)(H,33,37)(H4,29,30,31);2*1H3,(H,3,4)/t21-,22+,23?;;/m1../s1
InchI Key:GWPSYFXCUKYEBE-DJDJELKCSA-N
SMILES:CC(=O)O.CC(=O)O.C1CCN(C(C1)C(=O)NC(CCCN=C(N)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(CC3=CC=CC=C3)N
Appearance:White to off-white powder
Melting Point:N/A
Boiling Point:N/A
Density (Theoretical):N/A

Safety Information

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