Apigenin 7-[rhamnosyl-(1->2)-galacturonide]
HIT214312560
sdf文件结构编辑类似物检索
HIT ID: HIT214312560
Cas No: 124167-97-1
分子式: C27H28O15
分子量: 592.506
常用名: Apigenin 7-[rhamnosyl-(1->2)-galacturonide]
常用名: Apigenin 7-[rhamnosyl-(1->2)-galacturonide]
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (2S,3R,4S,5R,6S)-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxane-2-carboxylic acid
IUPAC: (2S,3R,4S,5R,6S)-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxane-2-carboxylic acid
SMILES: C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)oc(cc4=O)-c3ccc(O)cc3)O[C@@H]([C@H](O)[C@@H]2O)C(O)=O)[C@H](O)[C@H](O)[C@H]1O
SMILES: C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)oc(cc4=O)-c3ccc(O)cc3)O[C@@H]([C@H](O)[C@@H]2O)C(O)=O)[C@H](O)[C@H](O)[C@H]1O
InChI key: ONIIEJMYZDRHKM-JHUFFODMSA-N
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