Name: Shizukaol A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT213884880
Cas No:131984-98-0
常用名:Shizukaol A
IUPAC:methyl 2-[(1R,2S,8S,10S,12R,13S,14S,17S,19R,20S,21R,23Z)-21-hydroxy-5,13,20-trimethyl-9-methylidene-4,22-dioxo-3-oxaoctacyclo[14.7.1.0^{2,6}.0^{2,14}.0^{8,13}.0^{10,12}.0^{17,19}.0^{20,24}]tetracosa-5,16(24)-dien-23-ylidene]propanoate
IUPAC:methyl 2-[(1R,2S,8S,10S,12R,13S,14S,17S,19R,20S,21R,23Z)-21-hydroxy-5,13,20-trimethyl-9-methylidene-4,22-dioxo-3-oxaoctacyclo[14.7.1.0^{2,6}.0^{2,14}.0^{8,13}.0^{10,12}.0^{17,19}.0^{20,24}]tetracosa-5,16(24)-dien-23-ylidene]propanoate
InChI key:GQSUZVYXPAKHQW-SFVFYCNCSA-N

分子式:C31H34O6
分子量:502.607
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COC(=O)C(\C)=C1\[C@H]2C3=C(C[C@H]4[C@@]5(C)[C@@H]6C[C@@H]6C(=C)[C@@H]5CC5=C(C)C(=O)O[C@]245)[C@H]2C[C@H]2[C@]3(C)[C@@H](O)C1=O |c:8,23|
SMILES:COC(=O)C(\C)=C1\[C@H]2C3=C(C[C@H]4[C@@]5(C)[C@@H]6C[C@@H]6C(=C)[C@@H]5CC5=C(C)C(=O)O[C@]245)[C@H]2C[C@H]2[C@]3(C)[C@@H](O)C1=O |c:8,23|

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