A 121
HIT212711856
sdf文件结构编辑类似物检索
HIT ID: HIT212711856
Cas No: 68072-84-4
分子式: C18H30O5
分子量: 326.433
常用名: A 121
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 1.9764533
IUPAC: 1-[2,3-dimethyl-2-(2-methylbut-3-en-2-yl)-2,3-dihydrofuran-3-yl]-3,5-dihydroxy-4-methoxyhexan-2-one
IUPAC: 1-[2,3-dimethyl-2-(2-methylbut-3-en-2-yl)-2,3-dihydrofuran-3-yl]-3,5-dihydroxy-4-methoxyhexan-2-one
SMILES: COC(C(C)O)C(O)C(=O)CC1(C)C=COC1(C)C(C)(C)C=C |c:13|
SMILES: COC(C(C)O)C(O)C(=O)CC1(C)C=COC1(C)C(C)(C)C=C |c:13|
InChI key: BSIAHHIPMGVHJM-UHFFFAOYSA-N
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