Name: BChE-IN-9
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214433008
Cas No:2468035-31-4
常用名:BChE-IN-9
IUPAC:[(5aR,7aR,7bS,9aS,12S,13aR,15aR,15bR)-5,5,7a,7b,9a,12,15b-heptamethyl-1H,2H,3H,4H,5H,5aH,6H,7H,7aH,7bH,8H,9H,9aH,10H,11H,12H,13H,13aH,15H,15aH,15bH-chryseno[2,1-c]azepin-12-yl]methanol
IUPAC:[(5aR,7aR,7bS,9aS,12S,13aR,15aR,15bR)-5,5,7a,7b,9a,12,15b-heptamethyl-1H,2H,3H,4H,5H,5aH,6H,7H,7aH,7bH,8H,9H,9aH,10H,11H,12H,13H,13aH,15H,15aH,15bH-chryseno[2,1-c]azepin-12-yl]methanol
InChI key:HFULOZRUEGOFNH-DWJKITPBSA-N

分子式:C30H51NO
分子量:441.744
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C[C@@](C)(CO)CC[C@]1(C)CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CCCNC(C)(C)[C@]3([H])CC[C@@]12C
SMILES:[H][C@@]12C[C@@](C)(CO)CC[C@]1(C)CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CCCNC(C)(C)[C@]3([H])CC[C@@]12C

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