Ilekudinoside T
HIT212525491
sdf文件结构编辑类似物检索
HIT ID: HIT212525491
Cas No: 1227484-07-2
分子式: C47H74O17
分子量: 911.092
常用名: Ilekudinoside T
氢键受体数 (HBA): 16
氢键供体数 (HBD): 9
LogP: 1.214
IUPAC: (1R,4S,5R,10S,13R,18S,19S,20S)-19-hydroxy-10-{[(2S,3R,4S,5S)-5-hydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-4,5,9,9,13,19,20-heptamethyl-21-oxahexacyclo[18.2.2.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracos-16-en-22-one
IUPAC: (1R,4S,5R,10S,13R,18S,19S,20S)-19-hydroxy-10-{[(2S,3R,4S,5S)-5-hydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-4,5,9,9,13,19,20-heptamethyl-21-oxahexacyclo[18.2.2.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracos-16-en-22-one
SMILES: [H][C@]12C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)CC[C@@]11CC[C@](C)(OC1=O)[C@@]2(C)O |t:2|
SMILES: [H][C@]12C3=CCC4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@H](O)[C@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)[C@H]6O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)C(C)(C)C5CC[C@@]4(C)[C@]3(C)CC[C@@]11CC[C@](C)(OC1=O)[C@@]2(C)O |t:2|
InChI key: DPEYAJFUJJMJNO-CUMMFOPVSA-N
共显示3个结果
供应商规格单价货期纯度操作
TargetMol
SC
待询点击询价
Analyticon
SC
32893-4周 购物车
Mcule
SC
50204-5周 购物车
TargetMol | Target Loading
正在加载 ~