Serrin A | CAS 845959-98-0 | AnyMole

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HIT214316183

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HIT214316183

HIT ID:HIT214316183
Cas No:845959-98-0
常用名:Serrin A
IUPAC:(1S,4S,8R,9R,13S,16R)-9-ethoxy-11-hydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.0^{1,13}.0^{4,12}.0^{8,12}]nonadecane-2,18-dione
IUPAC:(1S,4S,8R,9R,13S,16R)-9-ethoxy-11-hydroxy-7,7-dimethyl-17-methylidene-3,10-dioxapentacyclo[14.2.1.0^{1,13}.0^{4,12}.0^{8,12}]nonadecane-2,18-dione
InChI key:BYOLCBRZEMRXHS-MPYJQGHOSA-N

分子式:C22H30O6
分子量:390.476
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C[C@]3(C(=O)C1=C)C(=O)O[C@@]1([H])CCC(C)(C)[C@@]4([H])[C@H](OCC)OC(O)C14[C@]3([H])CC2
SMILES:[H][C@@]12C[C@]3(C(=O)C1=C)C(=O)O[C@@]1([H])CCC(C)(C)[C@@]4([H])[C@H](OCC)OC(O)C14[C@]3([H])CC2

Serrin A shows weak to moderate cytotoxic activities (IC50<10 uM) against two human cancer cell lines.

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