Name: Kaempferol 3-sophoroside 7-rhamnoside
Rating: 5 (10 reviews)

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HIT ID:HIT212665609
Cas No:93098-79-4
常用名:Kaempferol 3-sophoroside 7-rhamnoside
常用名:Kaempferol 3-sophoroside 7-rhamnoside
别名:山柰酚-3-槐二糖-7-鼠李糖苷, Kaempferol 3-sophoroside-7-rhamnoside
别名:山柰酚-3-槐二糖-7-鼠李糖苷, Kaempferol 3-sophoroside-7-rhamnoside
IUPAC:3-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-7-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one
IUPAC:3-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-7-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one
InChI key:VRYWDBDPXMHHGE-IAYTZLMWSA-N

分子式:C33H40O20
分子量:756.663
氢键供体数 (HBD):12
氢键受体数 (HBA):20
LogP:-2.8332636
SMILES:C[C@@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)cc2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3=O)[C@H](O)[C@H](O)[C@H]1O
SMILES:C[C@@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)cc2)c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c3=O)[C@H](O)[C@H](O)[C@H]1O

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