| Formula |
C18H28N4O7 |
| IUPAC Name |
(2s)-2-amino-4-[4-[(2s)-2-amino-2-carboxy-ethyl]-1-[(5s)-5-amino-5-carboxy-pentyl]-5-hydroxy-pyridin-1-ium-3-yl]butanoate |
| Molecular Mass |
412.438 g·mol−1 |
| Heat of Formation |
-1174.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
21.87 ± 1.08 D |
| Volume |
482.32 Å 3 |
| Surface Area |
370.25 Å 2 |
| HOMO Energy |
-7.57 ± 0.55 eV |
| LUMO Energy |
-2.26 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5-[(3s)-3-amino-4-hydroxy-4-keto-butyl]-1-[(5s)-5-amino-6-hydroxy-6-keto-hexyl]-4-[(2s)-2-amino-3-hydroxy-3-keto-propyl]pyridin-1-ium-3-olate
- 5-[(3s)-3-amino-4-hydroxy-4-oxo-butyl]-1-[(5s)-5-amino-6-hydroxy-6-oxo-hexyl]-4-[(2s)-2-amino-3-hydroxy-3-oxo-propyl]pyridin-1-ium-3-olate
- 5-[(3s)-3-amino-4-hydroxy-4-oxobutyl]-1-[(5s)-5-amino-6-hydroxy-6-oxohexyl]-4-[(2s)-2-amino-3-hydroxy-3-oxopropyl]-3-pyridin-1-iumolate
- 5-[(3s)-3-amino-4-hydroxy-4-oxobutyl]-1-[(5s)-5-amino-6-hydroxy-6-oxohexyl]-4-[(2s)-2-amino-3-hydroxy-3-oxopropyl]pyridin-1-ium-3-olate
|
| InChIKey |
ZAHDXEIQWWLQQL-IHRRRGAJSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
O
N
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