Picroside II
HIT100138394
sdf文件结构编辑类似物检索
HIT ID: HIT100138394
Cas No: 39012-20-9
分子式: C23H28O13
分子量: 512.464
常用名: Picroside II
氢键受体数 (HBA): 12
氢键供体数 (HBD): 6
LogP: -1.4
IUPAC: (1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0^{2,4}]dec-7-en-5-yl 4-hydroxy-3-methoxybenzoate
IUPAC: (1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0^{2,4}]dec-7-en-5-yl 4-hydroxy-3-methoxybenzoate
SMILES: COc1cc(ccc1O)C(=O)O[C@@H]1[C@@H]2O[C@]2(CO)[C@@H]2[C@H]1C=CO[C@H]2O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |c:23|
SMILES: COc1cc(ccc1O)C(=O)O[C@@H]1[C@@H]2O[C@]2(CO)[C@@H]2[C@H]1C=CO[C@H]2O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |c:23|
InChI key: AKNILCMFRRDTEY-NUGKWEEESA-N
共显示3个结果
供应商规格单价货期纯度操作
TargetMol
SC
1631-3天 购物车
Analyticon
SC
35473-4周 购物车
Mcule
SC
1084-5周 购物车
TargetMol | Target Loading
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