Anticancer agent 96
HIT217584243
sdf文件结构编辑类似物检索
HIT ID: HIT217584243
Cas No: 1380680-89-6
分子式: C19H26O6
分子量: 350.411
常用名: Anticancer agent 96
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3aS,4R,10R,11aR)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,8H,9H,10H,11H,11aH-cyclodeca[b]furan-4-yl 2-methylprop-2-enoate
IUPAC: (3aS,4R,10R,11aR)-6,10-bis(hydroxymethyl)-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,8H,9H,10H,11H,11aH-cyclodeca[b]furan-4-yl 2-methylprop-2-enoate
SMILES: [H][C@@]12C[C@H](CO)CCC=C(CO)C[C@@H](OC(=O)C(C)=C)[C@@]1([H])C(=C)C(=O)O2
SMILES: [H][C@@]12C[C@H](CO)CCC=C(CO)C[C@@H](OC(=O)C(C)=C)[C@@]1([H])C(=C)C(=O)O2
InChI key: PIRNIYXVCYUDEY-QBPKDAKJSA-N
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