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(Q113324925)
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English
aceneuramate
chemical compound
5-acetamido-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonate
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Statements
instance of
type of chemical entity
0 references
subclass of
ion
0 references
mass
308.09870473590996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₁H₁₈NO₉⁻
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC([O-])=NC(C(O)CC(=O)C(=O)O)C(O)C(O)C(O)CO
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CC([O-])=N[C@@H]([C@@H](O)[C@H](O)[C@H](O)CO)[C@@H](O)CC(=O)C(=O)O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C11H19NO9/c1-4(14)12-8(5(15)2-6(16)11(20)21)10(19)9(18)7(17)3-13/h5,7-10,13,15,17-19H,2-3H2,1H3,(H,12,14)(H,20,21)/p-1/t5-,7+,8+,9+,10+/m0/s1
1 reference
stated in
ChEBI release 2022-06-13
InChIKey
KBGAYAKRZNYFFG-BOHATCBPSA-M
1 reference
stated in
ChEBI release 2022-06-13
PubChem CID
20843075
1 reference
matched by identifier from
InChIKey
InChIKey
KBGAYAKRZNYFFG-BOHATCBPSA-M
ChEBI ID
173083
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H19NO9/c1-4(14)12-8(5(15)2-6(16)11(20)21)10(19)9(18)7(17)3-13/h5,7-10,13,15,17-19H,2-3H2,1H3,(H,12,14)(H,20,21)/p-1/t5-,7+,8+,9+,10+/m0/s1
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