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(Q82953854)
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Penmacric acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyrrolidine alkaloid
0 references
mass
202.05897142
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₇H₁₀N₂O₅
0 references
canonical SMILES
NC(C(=O)O)C1CC(C(=O)O)NC1=O
0 references
found in taxon
Pentaclethra macrophylla
1 reference
stated in
Acide 3(R)[1′(S)-aminocarboxymethyl]2-pyrrolidone-5(S)-carboxylique dans les graines de Pentaclethra macrophylla
Clethra macrophylla
1 reference
stated in
Acide 3(R)[1′(S)-aminocarboxymethyl]2-pyrrolidone-5(S)-carboxylique dans les graines de Pentaclethra macrophylla
Identifiers
InChI
InChI=1S/C7H10N2O5/c8-4(7(13)14)2-1-3(6(11)12)9-5(2)10/h2-4H,1,8H2,(H,9,10)(H,11,12)(H,13,14)
0 references
InChIKey
QEFCFJFZZLNSPP-UHFFFAOYSA-N
0 references
CAS Registry Number
55297-13-7
0 references
PubChem CID
5231917
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QEFCFJFZZLNSPP-UHFFFAOYSA-N
541973
2 references
stated in
PubChem
retrieved
2 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QEFCFJFZZLNSPP-UHFFFAOYSA-N
ChEBI ID
167964
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H10N2O5/c8-4(7(13)14)2-1-3(6(11)12)9-5(2)10/h2-4H,1,8H2,(H,9,10)(H,11,12)(H,13,14)
UniChem compound ID
32003497
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80970616
1 reference
matched by identifier from
InChIKey
InChIKey
QEFCFJFZZLNSPP-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID001398145
0 references
Human Metabolome Database ID
HMDB0029436
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QEFCFJFZZLNSPP-UHFFFAOYSA-N
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