Chem
J-GLOBAL ID:200907001969115715
Nikkaji number:J1.344.898A
(2S,3R)-2-(3,4,5-Trihydroxyphenyl)-3-(3,4,5-trihydroxybenzoyl)-3,4-dihydro-2H-1-benzopyran-5,7-diol
(2S,3R)-2-(3,4,5-トリヒドロキシフェニル)-3-(3,4,5-トリヒドロキシベンゾイル)-3,4-ジヒドロ-2H-1-ベンゾピラン-5,7-ジオール
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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 H18 O10
Molecular formula furigana:
C22-H18-O10
Molecular weight:
442.376
InChI:
InChI=1S/C22H18O10/c23-10-5-13(24)11-7-12(19(29)8-1-14(25)20(30)15(26)2-8)22(32-18(11)6-10)9-3-16(27)21(31)17(28)4-9/h1-6,12,22-28,30-31H,7H2/t12-,22+/m0/s1
InChI key:
KGBNLSVBTXAQIV-AMXDTQDGSA-N
SMILES:
Oc1cc(O)c2C[C@H]([C@H](Oc2c1)c1cc(O)c(O)c(O)c1)C(=O)c1cc(O)c(O)c(O)c1
Systematic name (3):
(2S,3R)-2-(3,4,5-トリヒドロキシフェニル)-3-(3,4,5-トリヒドロキシベンゾイル)-3,4-ジヒドロ-2H-1-ベンゾピラン-5,7-ジオール
5-[(2S,3R)-5,7-ジヒドロキシ-3-(3,4,5-トリヒドロキシベンゾイル)-3,4-ジヒドロ-2H-1-ベンゾピラン-2-イル]ベンゼン-1,2,3-トリオール
5-[(2S,3R)-5,7-dihydroxy-3-(3,4,5-trihydroxybenzoyl)-3,4-dihydro-2H-1-benzopyran-2-yl]benzene-1,2,3-triol
Other name (1):
(2S,3R)-2-(3,4,5-Trihydroxyphenyl)-3-(3,4,5-trihydroxybenzoyl)-3,4-dihydro-2H-1-benzopyran-5,7-diol
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