Name: Xanthiside
Rating: 5 (10 reviews)

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HIT ID:HIT212665987
Cas No:866366-86-1
常用名:Xanthiside
别名:噻嗪二酮苷, Xanthiazone O-β-D-glucoside
IUPAC:8,8-dimethyl-7-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3,4,5,8-tetrahydro-2H-1,4-benzothiazine-3,5-dione
IUPAC:8,8-dimethyl-7-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-3,4,5,8-tetrahydro-2H-1,4-benzothiazine-3,5-dione
InChI key:AKXSDYSKIVXIJA-JCILWVLBSA-N

分子式:C17H23NO8S
分子量:401.43
氢键供体数 (HBD):5
氢键受体数 (HBA):8
LogP:-2.4546583
SMILES:CC1(C)C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(=O)C2=C1SCC(=O)N2 |c:17,21|
SMILES:CC1(C)C(CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(=O)C2=C1SCC(=O)N2 |c:17,21|

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