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(Q76279440)
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English
3-[[(3S,4S)-4-hydroxy-4-methyloxan-3-yl]amino]propanoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
203.115758024
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₉H₁₇NO₄
0 references
canonical SMILES
CC1(O)CCOCC1NCCC(=O)O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@]1(CCOC[C@@H]1NCCC(=O)O)O
0 references
Identifiers
InChI
InChI=1S/C9H17NO4/c1-9(13)3-5-14-6-7(9)10-4-2-8(11)12/h7,10,13H,2-6H2,1H3,(H,11,12)/t7-,9-/m0/s1
0 references
InChIKey
UZBZICLVTOAFGB-CBAPKCEASA-N
0 references
CAS Registry Number
134259-24-8
0 references
PubChem CID
3077439
2 references
stated in
PubChemLite tier0 and tier1
matched by identifier from
InChIKey
InChIKey
UZBZICLVTOAFGB-CBAPKCEASA-N
7012968
1 reference
matched by identifier from
InChIKey
InChIKey
UZBZICLVTOAFGB-CBAPKCEASA-N
UniChem compound ID
58271362
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40158615
2 references
stated in
Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard
matched by identifier from
InChIKey
InChIKey
UZBZICLVTOAFGB-CBAPKCEASA-N
DSSTOX compound identifier
DTXCID3081106
0 references
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