Spiracine
HIT214313053
sdf文件结构编辑类似物检索
HIT ID: HIT214313053
Cas No: 77156-24-2
分子式: C23H35NO10
分子量: 485.53
常用名: Spiracine
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,19R)-4,5,9-trihydroxy-4-(2-hydroxybutan-2-yl)-8-methyl-9-(propan-2-yl)-2,7,11-trioxa-16-azatricyclo[11.5.1.0^{16,19}]nonadec-13-ene-3,6,10-trione
IUPAC: (1R,19R)-4,5,9-trihydroxy-4-(2-hydroxybutan-2-yl)-8-methyl-9-(propan-2-yl)-2,7,11-trioxa-16-azatricyclo[11.5.1.0^{16,19}]nonadec-13-ene-3,6,10-trione
SMILES: CCC(C)(O)C1(O)C(O)C(=O)OC(C)C(O)(C(C)C)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23 |t:23|
SMILES: CCC(C)(O)C1(O)C(O)C(=O)OC(C)C(O)(C(C)C)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23 |t:23|
InChI key: ZMTPMWQLYFVWSP-YHWJFGDTSA-N
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