Retinyl glucoside
HIT212686758
sdf文件结构编辑类似物检索
HIT ID: HIT212686758
Cas No: 136778-12-6
分子式: C26H40O6
分子量: 448.6
常用名: Retinyl glucoside
氢键受体数 (HBA): 6
氢键供体数 (HBD): 4
LogP: 2.9232576
IUPAC: (2R,3R,4S,5S,6R)-2-{[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
IUPAC: (2R,3R,4S,5S,6R)-2-{[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohex-1-en-1-yl)nona-2,4,6,8-tetraen-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
SMILES: C\C(=C/CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C |c:24|
SMILES: C\C(=C/CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)\C=C\C=C(/C)\C=C\C1=C(C)CCCC1(C)C |c:24|
InChI key: CANKXEMSSRKEGQ-GICNYWJSSA-N
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