Lochnerine
HIT213887258
sdf文件结构编辑类似物检索
HIT ID: HIT213887258
Cas No: 522-47-4
分子式: C20H24N2O2
分子量: 324.424
常用名: Lochnerine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: [(1S,12S,13R,14R,15E)-15-ethylidene-7-methoxy-3,17-diazapentacyclo[12.3.1.0^{2,10}.0^{4,9}.0^{12,17}]octadeca-2(10),4,6,8-tetraen-13-yl]methanol
IUPAC: [(1S,12S,13R,14R,15E)-15-ethylidene-7-methoxy-3,17-diazapentacyclo[12.3.1.0^{2,10}.0^{4,9}.0^{12,17}]octadeca-2(10),4,6,8-tetraen-13-yl]methanol
SMILES: COc1ccc2[nH]c3[C@@H]4C[C@@H]5[C@@H](CO)[C@H](Cc3c2c1)N4C\C5=C\C |TLB:6:7:9.10.11:19,12:11:7.15.16:19,20:19:9.10.11:7.15.16,THB:21:10:7.15.16:19|
SMILES: COc1ccc2[nH]c3[C@@H]4C[C@@H]5[C@@H](CO)[C@H](Cc3c2c1)N4C\C5=C\C |TLB:6:7:9.10.11:19,12:11:7.15.16:19,20:19:9.10.11:7.15.16,THB:21:10:7.15.16:19|
InChI key: YTIVOMMYBBBYFH-BOPWJTLDSA-N
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