3-Epichromolaenide
HIT213884892
sdf文件结构编辑类似物检索
HIT ID: HIT213884892
Cas No: 89913-53-1
分子式: C22H28O7
分子量: 404.459
常用名: 3-Epichromolaenide
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (3aR,4R,9R,11aR)-9-(acetyloxy)-6,10-dimethyl-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)-6,10-dimethyl-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: CC(=O)O[C@@H]1C\C=C(C)\C[C@@H](OC(=O)C(\C)=C\CO)[C@@H]2[C@H](OC(=O)C2=C)\C=C1\C |c:6,27|
SMILES: CC(=O)O[C@@H]1C\C=C(C)\C[C@@H](OC(=O)C(\C)=C\CO)[C@@H]2[C@H](OC(=O)C2=C)\C=C1\C |c:6,27|
InChI key: FOCCASNSHDSZLN-OHRIODEJSA-N
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