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26605-36-7 | Heptanedioic acid, 2-amino-6-[(3-carboxy-1-oxopropyl)amino]-, (2S,6S)-
CAS No: 26605-36-7 Catalog No: AG002TU6 MDL No:
Product Description
Catalog Number:
AG002TU6
Chemical Name:
Heptanedioic acid, 2-amino-6-[(3-carboxy-1-oxopropyl)amino]-, (2S,6S)-
CAS Number:
26605-36-7
Molecular Formula:
C11H18N2O7
Molecular Weight:
290.2698
IUPAC Name:
(2S,6S)-2-amino-6-(3-carboxypropanoylamino)heptanedioic acid
InChI:
InChI=1S/C11H18N2O7/c12-6(10(17)18)2-1-3-7(11(19)20)13-8(14)4-5-9(15)16/h6-7H,1-5,12H2,(H,13,14)(H,15,16)(H,17,18)(H,19,20)/t6-,7-/m0/s1
InChI Key:
GLXUWZBUPATPBR-BQBZGAKWSA-N
SMILES:
O=C(N[C@H](C(=O)O)CCC[C@@H](C(=O)O)N)CCC(=O)O
Properties
Complexity:
383
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
290.111g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
290.272g/mol
Monoisotopic Mass:
290.111g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
167A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.9
Literature
| Title | Journal |
|---|---|
| Bacterial N-succinyl-L-diaminopimelic acid desuccinylase. Purification, partial characterization, and substrate specificity. | The Journal of biological chemistry 19880205 |
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