ABL-L
HIT214433530
sdf文件结构编辑类似物检索
HIT ID: HIT214433530
Cas No: 1613152-39-8
分子式: C29H46O6
分子量: 490.681
常用名: ABL-L
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3aR,4S,7aR)-5-[(2S)-5-(acetyloxy)pentan-2-yl]-6-methyl-3-methylidene-2-oxo-2,3,3a,4,7,7a-hexahydro-1-benzofuran-4-yl dodecanoate
IUPAC: (3aR,4S,7aR)-5-[(2S)-5-(acetyloxy)pentan-2-yl]-6-methyl-3-methylidene-2-oxo-2,3,3a,4,7,7a-hexahydro-1-benzofuran-4-yl dodecanoate
SMILES: [H][C@@]12CC(C)=C([C@@H](C)CCCOC(C)=O)[C@@H](OC(=O)CCCCCCCCCCC)[C@]1([H])C(=C)C(=O)O2
SMILES: [H][C@@]12CC(C)=C([C@@H](C)CCCOC(C)=O)[C@@H](OC(=O)CCCCCCCCCCC)[C@]1([H])C(=C)C(=O)O2
InChI key: XQHYGHMNUOFAQI-BZPPDAAYSA-N
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