Dehydroadynerigenin beta-neritrioside
HIT213886102
sdf文件结构编辑类似物检索
HIT ID: HIT213886102
Cas No: 143212-60-6
分子式: C42H62O17
分子量: 838.941
常用名: Dehydroadynerigenin beta-neritrioside
常用名: Dehydroadynerigenin beta-neritrioside
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 4-[(1S,3R,7R,10R,11S,14S,16R)-14-{[(2R,4R,5S,6R)-4-methoxy-6-methyl-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7,11-dimethyl-2-oxapentacyclo[8.8.0.0^{1,3}.0^{3,7}.0^{11,16}]octadec-5-en-6-yl]-2,5-dihydrofuran-2-one
IUPAC: 4-[(1S,3R,7R,10R,11S,14S,16R)-14-{[(2R,4R,5S,6R)-4-methoxy-6-methyl-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7,11-dimethyl-2-oxapentacyclo[8.8.0.0^{1,3}.0^{3,7}.0^{11,16}]octadec-5-en-6-yl]-2,5-dihydrofuran-2-one
SMILES: CO[C@@H]1C[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@]45O[C@@]44CC=C(C6=CC(=O)OC6)[C@@]4(C)CC[C@H]35)C2)O[C@H](C)[C@@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O |t:19,21|
SMILES: CO[C@@H]1C[C@H](O[C@H]2CC[C@@]3(C)[C@H](CC[C@@]45O[C@@]44CC=C(C6=CC(=O)OC6)[C@@]4(C)CC[C@H]35)C2)O[C@H](C)[C@@H]1O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O |t:19,21|
InChI key: DVFXEUYOOYUTOA-NLJMNTBYSA-N
共显示4个结果
供应商规格单价货期纯度操作
TargetMol
SC
4890 购物车
AnyMole
SC
-点击询价
Mcule
SC
75094-5周 购物车
Mcule
SC
98564-5周 购物车
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