Formula |
C17H20N2O9S |
IUPAC Name |
(2s)-2-[[4-[(2r)-2-carboxypyrrolidin-1-yl]sulfonylbenzoyl]amino]pentanedioic acid |
Molecular Mass |
428.414 g·mol−1 |
Heat of Formation |
-1563.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.41 ± 1.08 D |
Volume |
470.13 Å 3 |
Surface Area |
404.55 Å 2 |
HOMO Energy |
-9.72 ± 0.55 eV |
LUMO Energy |
-1.24 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2s)-2-[[4-[(2r)-2-carboxypyrrolidin-1-yl]sulfonylbenzoyl]amino]glutaric acid
- (2s)-2-[[4-[(2r)-2-carboxypyrrolidin-1-yl]sulfonylbenzoyl]amino]pentanedioic acid
- (2s)-2-[[4-[(2r)-2-carboxypyrrolidin-1-yl]sulfonylphenyl]carbonylamino]pentanedioic acid
- (2s)-2-[[[4-[[(2r)-2-carboxy-1-pyrrolidinyl]sulfonyl]phenyl]-oxomethyl]amino]pentanedioic acid
- 4-[[glutamic acid]-carbonyl]-benzene-sulfonyl-d-proline
- tp3
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InChIKey |
NDDOUBGQRWFVQM-QWHCGFSZSA-N |
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Elements |
H
C
S
O
N
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