HIT ID: HIT218848930
Cas No: 121123-61-3
分子式: C18H23NO6
分子量: 349.383
常用名: Spartioidine N-oxide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (4E)-4-ethylidene-7-hydroxy-7-methyl-6-methylidene-3,8-dioxo-2,9-dioxa-14-azatricyclo[9.5.1.0^{14,17}]heptadec-11-en-14-ium-14-olate
IUPAC: (4E)-4-ethylidene-7-hydroxy-7-methyl-6-methylidene-3,8-dioxo-2,9-dioxa-14-azatricyclo[9.5.1.0^{14,17}]heptadec-11-en-14-ium-14-olate
SMILES: C\C=C1/CC(=C)C(C)(O)C(=O)OCC2=CC[N+]3([O-])CCC(OC1=O)C23
SMILES: C\C=C1/CC(=C)C(C)(O)C(=O)OCC2=CC[N+]3([O-])CCC(OC1=O)C23
InChI key: COHUFMBRBUPZPA-UUILKARUSA-N
