Eupalinolide I
HIT214315894
sdf文件结构编辑类似物检索
HIT ID: HIT214315894
Cas No: 1402067-84-8
分子式: C24H30O9
分子量: 462.495
常用名: Eupalinolide I
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3aR,4R,9R,11aR)-9-(acetyloxy)-6-[(acetyloxy)methyl]-10-methyl-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-4-yl (2E)-4-hydroxy-2-methylbut-2-enoate
IUPAC: (3aR,4R,9R,11aR)-9-(acetyloxy)-6-[(acetyloxy)methyl]-10-methyl-3-methylidene-2-oxo-2H,3H,3aH,4H,5H,8H,9H,11aH-cyclodeca[b]furan-4-yl (2E)-4-hydroxy-2-methylbut-2-enoate
SMILES: [H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(COC(C)=O)=C/C[C@@H](OC(C)=O)\C(C)=C/2)OC(=O)C(\C)=C\CO |c:17,26|
SMILES: [H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(COC(C)=O)=C/C[C@@H](OC(C)=O)\C(C)=C/2)OC(=O)C(\C)=C\CO |c:17,26|
InChI key: HPWMABTYJYZFLK-XPXZTDHESA-N
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