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144110-37-2 | Benzenepropanoic acid, α-[(3S)-3-amino-6-[(aminoiminomethyl)amino]-2-oxohexyl]-, (αR)-, sulfate (2:1)
CAS No: 144110-37-2 Catalog No: AG001IYH MDL No:
Product Description
Catalog Number:
AG001IYH
Chemical Name:
Benzenepropanoic acid, α-[(3S)-3-amino-6-[(aminoiminomethyl)amino]-2-oxohexyl]-, (αR)-, sulfate (2:1)
CAS Number:
144110-37-2
Molecular Formula:
C32H50N8O10S
Molecular Weight:
738.8520
IUPAC Name:
5-amino-2-benzyl-8-(diaminomethylideneamino)-4-oxooctanoic acid;sulfuric acid
InChI:
InChI=1S/2C16H24N4O3.H2O4S/c2*17-13(7-4-8-20-16(18)19)14(21)10-12(15(22)23)9-11-5-2-1-3-6-11;1-5(2,3)4/h2*1-3,5-6,12-13H,4,7-10,17H2,(H,22,23)(H4,18,19,20);(H2,1,2,3,4)
InChI Key:
MOKRJPVCHKXEMO-UHFFFAOYSA-N
SMILES:
OS(=O)(=O)O.NN=CNCCC[C@@H](C(=O)C[C@H](C(=O)O)Cc1ccccc1)N.NN=CNCCC[C@@H](C(=O)C[C@H](C(=O)O)Cc1ccccc1)N
Properties
Complexity:
497
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
738.337g/mol
Formal Charge:
0
Heavy Atom Count:
51
Hydrogen Bond Acceptor Count:
14
Hydrogen Bond Donor Count:
10
Isotope Atom Count:
0
Molecular Weight:
738.858g/mol
Monoisotopic Mass:
738.337g/mol
Rotatable Bond Count:
20
Topological Polar Surface Area:
373A^2
Undefined Atom Stereocenter Count:
4
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Collagen production in cardiac fibroblasts during inhibition of aminopeptidase B. | Journal of the renin-angiotensin-aldosterone system : JRAAS 20050901 |
| Cloning and characterization of a leucyl aminopeptidase from three pathogenic Leishmania species. | The Journal of biological chemistry 20020719 |
| Studies on the aminopeptidase activities of Porphyromonas gingivalis. | Oral microbiology and immunology 20010801 |
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