Name: Juncin E
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317574
Cas No:129602-22-8
常用名:Juncin E
别名:(-)-Juncin E
IUPAC:2',14',15',16'-tetrakis(acetyloxy)-8'-chloro-3'-hydroxy-4',13'-dimethyl-9'-methylidene-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0^{3,7}]heptadecan]-10'-en-12'-yl acetate
IUPAC:2',14',15',16'-tetrakis(acetyloxy)-8'-chloro-3'-hydroxy-4',13'-dimethyl-9'-methylidene-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0^{3,7}]heptadecan]-10'-en-12'-yl acetate
InChI key:CMKNGEIJCJJGAQ-UHFFFAOYSA-N

分子式:C30H37ClO14
分子量:657.06
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC1C(=O)OC2C(Cl)C(=C)C=CC(OC(C)=O)C3(C)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C4(CO4)C3C(OC(C)=O)C12O |w:11.11|
SMILES:CC1C(=O)OC2C(Cl)C(=C)C=CC(OC(C)=O)C3(C)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C4(CO4)C3C(OC(C)=O)C12O |w:11.11|

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