Name: Scillascillol
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214316170
Cas No:2023822-39-9
常用名:Scillascillol
IUPAC:(1S,3'R,3''S,3aS,4''R,5'S,5aR,6S,7S,9aS,11aS)-3'',7-dihydroxy-6-(hydroxymethyl)-3',3a,4'',6,9a,11a-hexamethyl-2,3,3a,4,5,5a,6,7,8,9,9a,10,11,11a-tetradecahydrodispiro[cyclopenta[a]phenanthrene-1,2':5',2''-bis(oxolane)]-5''-one
IUPAC:(1S,3'R,3''S,3aS,4''R,5'S,5aR,6S,7S,9aS,11aS)-3'',7-dihydroxy-6-(hydroxymethyl)-3',3a,4'',6,9a,11a-hexamethyl-2,3,3a,4,5,5a,6,7,8,9,9a,10,11,11a-tetradecahydrodispiro[cyclopenta[a]phenanthrene-1,2':5',2''-bis(oxolane)]-5''-one
InChI key:CBSGBWZNJGIOHF-WCUHBYDCSA-N

分子式:C30H46O6
分子量:502.692
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12CCC3=C(CC[C@@]4(C)[C@@]3(C)CC[C@@]43O[C@@]4(C[C@H]3C)OC(=O)[C@H](C)[C@@H]4O)[C@@]1(C)CC[C@H](O)[C@]2(C)CO |t:4|
SMILES:[H][C@@]12CCC3=C(CC[C@@]4(C)[C@@]3(C)CC[C@@]43O[C@@]4(C[C@H]3C)OC(=O)[C@H](C)[C@@H]4O)[C@@]1(C)CC[C@H](O)[C@]2(C)CO |t:4|

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