Anticancer agent 217
HIT218849864
sdf文件结构编辑类似物检索
HIT ID: HIT218849864
Cas No: 2916406-04-5
分子式: C23H21N3O6
分子量: 435.436
常用名: Anticancer agent 217
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (5S)-14-[(1R)-1-aminoethyl]-5-ethyl-5-hydroxy-7,18,20-trioxa-11,24-diazahexacyclo[11.11.0.0^{2,11}.0^{4,9}.0^{15,23}.0^{17,21}]tetracosa-1(24),2,4(9),13,15,17(21),22-heptaene-6,10-dione
IUPAC: (5S)-14-[(1R)-1-aminoethyl]-5-ethyl-5-hydroxy-7,18,20-trioxa-11,24-diazahexacyclo[11.11.0.0^{2,11}.0^{4,9}.0^{15,23}.0^{17,21}]tetracosa-1(24),2,4(9),13,15,17(21),22-heptaene-6,10-dione
SMILES: CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4cc5OCOc5cc4c([C@@H](C)N)c3Cn1c2=O
SMILES: CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4cc5OCOc5cc4c([C@@H](C)N)c3Cn1c2=O
InChI key: UKJRPMXYHVCOGK-WYVULQQZSA-N
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