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(Q6172533)
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English
(±)-betalamic acid
group of stereoisomers
(4E)-4-(2-oxoethylidene)-2,3-dihydro-1H-pyridine-2,6-dicarboxylic acid
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
211.048072388
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₉H₉NO₅
1 reference
imported from Wikimedia project
Spanish Wikipedia
canonical SMILES
C1C(NC(=CC1=CC=O)C(=O)O)C(=O)O
0 references
isomeric SMILES
O=C/C=C1/C=C(C(=O)O)NC(C(=O)O)C1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C9H9NO5/c11-2-1-5-3-6(8(12)13)10-7(4-5)9(14)15/h1-3,7,10H,4H2,(H,12,13)(H,14,15)/b5-1-
0 references
InChIKey
YQDKULBMDMPFLH-KTAJNNJTSA-N
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CAS Registry Number
95585-98-1
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PubChem CID
18317085
reason for deprecated rank
withdrawn identifier value
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KEGG ID
C08538
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