Trehalose-6,6'-dibehenate
HIT214983270
sdf文件结构编辑类似物检索
HIT ID: HIT214983270
Cas No: 66758-35-8
分子式: C56H106O13
分子量: 987.451
常用名: Trehalose-6,6'-dibehenate
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: [(2R,3S,4S,5R,6R)-6-{[(2R,3R,4S,5S,6R)-6-[(docosanoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl docosanoate
IUPAC: [(2R,3S,4S,5R,6R)-6-{[(2R,3R,4S,5S,6R)-6-[(docosanoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl docosanoate
SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@H](O[C@H]2O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H]1O[C@H](O[C@H]2O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChI key: ZLJJDBSDZSZVTF-LXOQPCSCSA-N
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