Chem
J-GLOBAL ID:200907071169337351
Nikkaji number:J12.403F
Gabaculine
ガバクリン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C7 H9 NO2
Molecular formula furigana:
C7-H9-N-O2
Molecular weight:
139.154
InChI:
InChI=1S/C7H9NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-3,6H,4,8H2,(H,9,10)/t6-/m1/s1
InChI key:
KFNRJXCQEJIBER-ZCFIWIBFSA-N
SMILES:
N[C@H]1CC(=CC=C1)C(=O)O
Systematic name (4):
(S)-5-アミノ-1,3-シクロヘキサジエン-1-カルボン酸
[S,(-)]-5-アミノ-1,3-シクロヘキサジエン-1-カルボン酸
(5S)-5-アミノシクロヘキサ-1,3-ジエン-1-カルボン酸
(5S)-5-aminocyclohexa-1,3-diene-1-carboxylic acid
Other name (6):
ガバクリン
(-)-ガバクリン
Gabaculine
(-)-Gabaculine
(S)-5-Amino-1,3-cyclohexadiene-1-carboxylic acid
[S,(-)]-5-Amino-1,3-cyclohexadiene-1-carboxylic acid
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CAS registry number:
59556-29-5
Application (2):
enzyme inhibitor
, anticonvulsant
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