Formula |
C20H19NO5 |
IUPAC Name |
(1s,2s)-2-[(1s)-1-amino-1-carboxy-2-(9h-xanthen-9-yl)ethyl]cyclopropanecarboxylic acid |
Molecular Mass |
353.369 g·mol−1 |
Heat of Formation |
-631.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.78 ± 1.08 D |
Volume |
409.02 Å 3 |
Surface Area |
313.62 Å 2 |
HOMO Energy |
-8.79 ± 0.55 eV |
LUMO Energy |
-0.40 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (1s,2s)-2-[(1s)-1-amino-2-hydroxy-2-keto-1-(9h-xanthen-9-ylmethyl)ethyl]cyclopropane-1-carboxylic acid
- (1s,2s)-2-[(1s)-1-amino-2-hydroxy-2-oxo-1-(9h-xanthen-9-ylmethyl)ethyl]-1-cyclopropanecarboxylic acid
- (1s,2s)-2-[(1s)-1-amino-2-hydroxy-2-oxo-1-(9h-xanthen-9-ylmethyl)ethyl]cyclopropane-1-carboxylic acid
- (1s,2s)-2-[(2s)-2-amino-1-hydroxy-1-oxo-3-(9h-xanthen-9-yl)propan-2-yl]cyclopropane-1-carboxylic acid
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InChIKey |
VLZBRVJVCCNPRJ-KPHUOKFYSA-N |
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Links |
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Elements |
H
C
O
N
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