Chem
J-GLOBAL ID:200907023517098558
Nikkaji number:J707.565K
α-D-Glucopyranuronosyl α-D-glucopyranosiduronic acid
α-D-グルコピラヌロノシルα-D-グルコピラノシドウロン酸
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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:
C12 H18 O13
Molecular formula furigana:
C12-H18-O13
Molecular weight:
370.263
InChI:
InChI=1S/C12H18O13/c13-1-3(15)7(9(19)20)23-11(5(1)17)25-12-6(18)2(14)4(16)8(24-12)10(21)22/h1-8,11-18H,(H,19,20)(H,21,22)/t1-,2-,3-,4-,5+,6+,7-,8-,11+,12+/m0/s1
InChI key:
KQTVLOYYWRNNBS-OTQWMBDASA-N
SMILES:
O[C@@H]1[C@@H](O)[C@@H](O[C@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)O[C@@H]([C@H]1O)C(=O)O
Systematic name (3):
α-D-グルコピラヌロノシルα-D-グルコピラノシドウロン酸
(2S,3S,4S,5R,6R)-6-{[(2R,3R,4S,5S,6S)-6-カルボキシ-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}-3,4,5-トリヒドロキシオキサン-2-カルボン酸
(2S,3S,4S,5R,6R)-6-{[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
Other name (1):
α-D-Glucopyranuronosyl α-D-glucopyranosiduronic acid
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