Name: 16-Oxoalisol A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214314446
Cas No:124515-98-6
常用名:16-Oxoalisol A
别名:16-氧代泽泻醇A
IUPAC:(3aR,3bS,5aR,9aS,9bS,10S)-10-hydroxy-3a,3b,6,6,9a-pentamethyl-1-[(2R,4S,5R)-4,5,6-trihydroxy-6-methylheptan-2-yl]-2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H-cyclopenta[a]phenanthrene-2,7-dione
IUPAC:(3aR,3bS,5aR,9aS,9bS,10S)-10-hydroxy-3a,3b,6,6,9a-pentamethyl-1-[(2R,4S,5R)-4,5,6-trihydroxy-6-methylheptan-2-yl]-2H,3H,3aH,3bH,4H,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H-cyclopenta[a]phenanthrene-2,7-dione
InChI key:CUDQRGCYJUHPER-KXVAGGRESA-N

分子式:C30H48O6
分子量:504.708
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12CC[C@@]3(C)[C@@]([H])([C@@H](O)CC4=C([C@H](C)C[C@H](O)[C@@H](O)C(C)(C)O)C(=O)C[C@]34C)[C@@]1(C)CCC(=O)C2(C)C |c:11|
SMILES:[H][C@@]12CC[C@@]3(C)[C@@]([H])([C@@H](O)CC4=C([C@H](C)C[C@H](O)[C@@H](O)C(C)(C)O)C(=O)C[C@]34C)[C@@]1(C)CCC(=O)C2(C)C |c:11|

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