Name: Licorice glycoside C2
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT212673116
Cas No:202657-55-4
常用名:Licorice glycoside C2
别名:甘草苷 C2
IUPAC:[(3S,4R,5S)-5-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-{4-[(2S)-7-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]phenoxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
IUPAC:[(3S,4R,5S)-5-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-{4-[(2S)-7-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl]phenoxy}-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
InChI key:GSIREHLZHMQJNR-GUEBRSMLSA-N

分子式:C36H38O16
分子量:726.684
氢键供体数 (HBD):7
氢键受体数 (HBA):15
LogP:1.5167603
SMILES:[H][C@@]1(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc2ccc(cc2)[C@@H]2CC(=O)c3ccc(O)cc3O2)OC[C@](O)(COC(=O)\C=C\c2ccc(O)c(OC)c2)[C@H]1O
SMILES:[H][C@@]1(O[C@@H]2[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]2Oc2ccc(cc2)[C@@H]2CC(=O)c3ccc(O)cc3O2)OC[C@](O)(COC(=O)\C=C\c2ccc(O)c(OC)c2)[C@H]1O

Licorice glycoside C2 is a oleanane-type triterpene oligoglycoside isolated from Glycyrrhiza uralensis.

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