Name: Ohchinin
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214316090
Cas No:67023-80-7
常用名:Ohchinin
IUPAC:(1R,2S,4R,6R,9R,10R,11R,12S,14R,15R,18R)-6-(furan-3-yl)-14-hydroxy-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0^{2,9}.0^{4,8}.0^{15,18}]octadec-7-en-12-yl (2E)-3-phenylprop-2-enoate
IUPAC:(1R,2S,4R,6R,9R,10R,11R,12S,14R,15R,18R)-6-(furan-3-yl)-14-hydroxy-10-(2-methoxy-2-oxoethyl)-7,9,11,15-tetramethyl-3,17-dioxapentacyclo[9.6.1.0^{2,9}.0^{4,8}.0^{15,18}]octadec-7-en-12-yl (2E)-3-phenylprop-2-enoate
InChI key:FCOMMYNXUJVOPV-VSCMBUAFSA-N

分子式:C36H42O8
分子量:602.724
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C[C@]([H])(C(C)=C1[C@@]1(C)[C@H](CC(=O)OC)[C@@]3(C)[C@H](C[C@@H](O)[C@@]4(C)CO[C@@]([H])([C@@]1([H])O2)[C@]34[H])OC(=O)\C=C\c1ccccc1)c1ccoc1 |c:6|
SMILES:[H][C@@]12C[C@]([H])(C(C)=C1[C@@]1(C)[C@H](CC(=O)OC)[C@@]3(C)[C@H](C[C@@H](O)[C@@]4(C)CO[C@@]([H])([C@@]1([H])O2)[C@]34[H])OC(=O)\C=C\c1ccccc1)c1ccoc1 |c:6|

Ohchinin exhibits potent inhibitory activities with 26 - 66% reduction of melanin content at 100 μm concentration with almost no or low toxicity to the B16 melanoma cells (70 - 99% cell viability at 100 μm).

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