Yanangin
HIT212718801
sdf文件结构编辑类似物检索
HIT ID: HIT212718801
Cas No: 105705-86-0
分子式: C36H36N2O6
分子量: 592.692
常用名: Yanangin
氢键受体数 (HBA): 6
氢键供体数 (HBD): 2
LogP: 5.860454
IUPAC: 16,27-dimethoxy-7,22-dimethyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.1^{4,30}.1^{10,14}.1^{15,19}.0^{3,8}.0^{25,33}.0^{28,32}]hexatriaconta-1,3,10,12,14(36),15,17,19(35),25,27,30(34),32-dodecaene-13,26-diol
IUPAC: 16,27-dimethoxy-7,22-dimethyl-29,31-dioxa-7,22-diazaoctacyclo[19.9.3.1^{4,30}.1^{10,14}.1^{15,19}.0^{3,8}.0^{25,33}.0^{28,32}]hexatriaconta-1,3,10,12,14(36),15,17,19(35),25,27,30(34),32-dodecaene-13,26-diol
SMILES: COc1ccc2CC3N(C)CCc4c(O)c(OC)c5Oc6cc7CCN(C)C(Cc8ccc(O)c(c8)-c1c2)c7cc6Oc5c34
SMILES: COc1ccc2CC3N(C)CCc4c(O)c(OC)c5Oc6cc7CCN(C)C(Cc8ccc(O)c(c8)-c1c2)c7cc6Oc5c34
InChI key: SKVLZQWBNXMJEZ-UHFFFAOYSA-N
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