Name: Isoorientin 2''-O-rhamnoside
Rating: 5 (10 reviews)

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HIT ID:HIT214311530
Cas No:50980-94-4
常用名:Isoorientin 2''-O-rhamnoside
IUPAC:2-(3,4-dihydroxyphenyl)-6-[(2S,3R,4S,5S,6R)-5-{[(2S,3R,4R,5R,6S)-6-{[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-4-hydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-4H-chromen-4-one
IUPAC:2-(3,4-dihydroxyphenyl)-6-[(2S,3R,4S,5S,6R)-5-{[(2S,3R,4R,5R,6S)-6-{[(2S,3R,4S,5S,6R)-2-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-6-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-4-hydroxy-6-(hydroxymethyl)-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-4H-chromen-4-one
InChI key:KAMWMNDRMXBMLM-HIAWRXJUSA-N

分子式:C54H58O30
分子量:1187.028
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OC[C@@H]3O[C@@H](O[C@@H]4[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]4c4c(O)cc5oc(cc(=O)c5c4O)-c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]3O)[C@@H](CO)O[C@H]2c2c(O)cc3oc(cc(=O)c3c2O)-c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
SMILES:C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@H](OC[C@@H]3O[C@@H](O[C@@H]4[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]4c4c(O)cc5oc(cc(=O)c5c4O)-c4ccc(O)c(O)c4)[C@H](O)[C@H](O)[C@H]3O)[C@@H](CO)O[C@H]2c2c(O)cc3oc(cc(=O)c3c2O)-c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O

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