Alginic acid
HIT212687533
sdf文件结构编辑类似物检索
HIT ID: HIT212687533
Cas No: 9005-32-7
分子式: C14H22O13
分子量: 398.317
常用名: Alginic acid
氢键受体数 (HBA): 13
氢键供体数 (HBD): 6
LogP: -2.7765727
IUPAC: 6-[(2-carboxy-4,5-dihydroxy-6-methoxyoxan-3-yl)oxy]-4,5-dihydroxy-3-methoxyoxane-2-carboxylic acid
IUPAC: 6-[(2-carboxy-4,5-dihydroxy-6-methoxyoxan-3-yl)oxy]-4,5-dihydroxy-3-methoxyoxane-2-carboxylic acid
SMILES: COC1OC(C(OC2OC(C(OC)C(O)C2O)C(O)=O)C(O)C1O)C(O)=O
SMILES: COC1OC(C(OC2OC(C(OC)C(O)C2O)C(O)=O)C(O)C1O)C(O)=O
InChI key: GKFPPCXIBHQRQT-UHFFFAOYSA-N
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