Chem
J-GLOBAL ID:200907010867131731
Nikkaji number:J438.967K
6-O-Methyl-2-O,3-O,4-O-tripivaloyl-α-D-glucopyranuronosyl bromide
6-O-メチル-2-O,3-O,4-O-トリピバロイル-α-D-グルコピラヌロノシルブロミド
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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:
C22 H35 BrO9
Molecular formula furigana:
C22-H35-BR-O9
Molecular weight:
523.417
InChI:
InChI=1S/C22H35BrO9/c1-20(2,3)17(25)30-11-12(31-18(26)21(4,5)6)14(16(24)28-10)29-15(23)13(11)32-19(27)22(7,8)9/h11-15H,1-10H3/t11-,12-,13+,14-,15-/m0/s1
InChI key:
GLAKMLRVJQHZBU-RMEBNNNOSA-N
SMILES:
COC(=O)[C@H]1O[C@H](Br)[C@H](OC(=O)C(C)(C)C)[C@@H](OC(=O)C(C)(C)C)[C@@H]1OC(=O)C(C)(C)C
Systematic name (4):
6-O-メチル-2-O,3-O,4-O-トリピバロイル-α-D-グルコピラヌロノシルブロミド
1-ブロモ-2-O,3-O,4-O-トリピバロイル-1-デオキシ-α-D-グルコピラヌロン酸メチル
メチル (2S,3S,4S,5R,6R)-6-ブロモ-3,4,5-トリス[(2,2-ジメチルプロパノイル)オキシ]オキサン-2-カルボキシラート
methyl (2S,3S,4S,5R,6R)-6-bromo-3,4,5-tris[(2,2-dimethylpropanoyl)oxy]oxane-2-carboxylate
Other name (2):
6-O-Methyl-2-O,3-O,4-O-tripivaloyl-α-D-glucopyranuronosyl bromide
1-Bromo-2-O,3-O,4-O-tripivaloyl-1-deoxy-α-D-glucopyranuronic acid methyl ester
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