5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0^{2,11}.0^{3,8}.0^{15,20}]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol, Epiafzelechin-(2beta-O->7,4beta->8)-ent-epicatechin
HIT218832772
sdf文件结构编辑类似物检索
HIT ID: HIT218832772
Cas No:
分子式: C30H24O11
分子量: 560.511
常用名: 5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0^{2,11}.0^{3,8}.0^{15,20}]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol, Epiafzelechin-(2beta-O->7,4beta->8)-ent-epicatechin
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 5-(3,4-dihydroxyphenyl)-13-(4-hydroxyphenyl)-4,12,14-trioxapentacyclo[11.7.1.0^{2,11}.0^{3,8}.0^{15,20}]henicosa-2(11),3(8),9,15,17,19-hexaene-6,9,17,19,21-pentol
SMILES: OC1Cc2c(O)cc3OC4(Oc5cc(O)cc(O)c5C(C4O)c3c2OC1c1ccc(O)c(O)c1)c1ccc(O)cc1
InChI key: MXKKFADFYXJREN-UHFFFAOYSA-N
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