Formula |
C11H17NO8 |
IUPAC Name |
(1r,2r,3s,5s,7r)-2-acetamido-7-[(1r)-1,2-dihydroxyethyl]-3-hydroxy-6,8-dioxabicyclo[3.2.1]octane-5-carboxylic acid |
Molecular Mass |
291.255 g·mol−1 |
Heat of Formation |
-1495.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.53 ± 1.08 D |
Volume |
319.03 Å 3 |
Surface Area |
280.96 Å 2 |
HOMO Energy |
-9.90 ± 0.55 eV |
LUMO Energy |
-0.11 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2,7-anhydro-neu5ac
- 2-acetylamino-7-(1,2-dihydroxy-ethyl)-3-hydroxy-6,8-dioxa-bicyclo[3.2.1]octane-5-carboxylic acid
- 5-acetamido-2,7-anhydro-3,5-dideoxy-d-glycero-alpha-d-galacto-non-2-ulopyranosonic acid
- n-acetyl-2,7-anhydro-alpha-neuraminic acid
- skd
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InChIKey |
NCMJSVDTRDLWJE-YRMXFSIDSA-N |
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Links |
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Elements |
H
C
O
N
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