Name: Thonningianin B
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214315465
Cas No:271579-12-5
常用名:Thonningianin B
别名:赶黄草苷 B
IUPAC:13-[3,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.0^{2,7}.0^{10,15}]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione
IUPAC:13-[3,5-dihydroxy-4-(3-phenylpropanoyl)phenoxy]-3,4,5,11,12,21,22,23-octahydroxy-9,14,17-trioxatetracyclo[17.4.0.0^{2,7}.0^{10,15}]tricosa-1(23),2,4,6,19,21-hexaene-8,18-dione
InChI key:UJNCWORGHSATHA-UHFFFAOYSA-N

分子式:C35H30O17
分子量:722.608
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:OC1C(O)C2OC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)OCC2OC1Oc1cc(O)c(C(=O)CCc2ccccc2)c(O)c1
SMILES:OC1C(O)C2OC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)OCC2OC1Oc1cc(O)c(C(=O)CCc2ccccc2)c(O)c1

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