Name: Sapelin A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214320213
Cas No:26790-93-2
常用名:Sapelin A
别名:NSC-270046, NSC270046, NSC 270046
IUPAC:(2R,3R,5S)-5-[(1S,3aS,5aR,7R,9aR,9bR,11aS)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-(2-hydroxypropan-2-yl)oxan-3-ol
IUPAC:(2R,3R,5S)-5-[(1S,3aS,5aR,7R,9aR,9bR,11aS)-7-hydroxy-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-(2-hydroxypropan-2-yl)oxan-3-ol
InChI key:YHJGJKRPDMVIKU-YXSNRNNOSA-N

分子式:C30H50O4
分子量:474.726
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@]1(CC[C@]2(C)C3=CC[C@@]4([H])C(C)(C)[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]12C)[C@@]1([H])CO[C@H]([C@H](O)C1)C(C)(C)O |t:6|
SMILES:[H][C@]1(CC[C@]2(C)C3=CC[C@@]4([H])C(C)(C)[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@@]12C)[C@@]1([H])CO[C@H]([C@H](O)C1)C(C)(C)O |t:6|

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