Chem
J-GLOBAL ID:201007043215539867
Nikkaji number:J2.882.141G
(4S)-2-(2,3-Dihydroxyphenyl)-5β-methyl-2-oxazoline-4-carboxylic acid
(4S)-2-(2,3-ジヒドロキシフェニル)-5β-メチル-2-オキサゾリン-4-カルボン酸
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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:
C11 H11 NO5
Molecular formula furigana:
C11-H11-N-O5
Molecular weight:
237.211
InChI:
InChI=1S/C11H11NO5/c1-5-8(11(15)16)12-10(17-5)6-3-2-4-7(13)9(6)14/h2-5,8,13-14H,1H3,(H,15,16)/t5-,8+/m1/s1
InChI key:
CARURCVPEGMOGV-XRGYYRRGSA-N
SMILES:
C[C@H]1OC(=N[C@@H]1C(=O)O)c1cccc(O)c1O
Systematic name (3):
(4S)-2-(2,3-ジヒドロキシフェニル)-5β-メチル-2-オキサゾリン-4-カルボン酸
(4S,5R)-2-(2,3-ジヒドロキシフェニル)-5-メチル-4,5-ジヒドロ-1,3-オキサゾール-4-カルボン酸
(4S,5R)-2-(2,3-dihydroxyphenyl)-5-methyl-4,5-dihydro-1,3-oxazole-4-carboxylic acid
Other name (1):
(4S)-2-(2,3-Dihydroxyphenyl)-5β-methyl-2-oxazoline-4-carboxylic acid
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