Name: Felipyrine
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT219201205
Cas No:2566976-46-1
常用名:Felipyrine
别名:PYPEPYRONE, 2-PYRROLIDINONE, 1-PHENYL-3-(1-PIPERIDINYL)-
别名:PYPEPYRONE, 2-PYRROLIDINONE, 1-PHENYL-3-(1-PIPERIDINYL)-
IUPAC:methyl (2S)-2-({[(2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicen-2-yl]carbamoyl}amino)propanoate
IUPAC:methyl (2S)-2-({[(2R,4aS,6aS,12bR,14aS,14bR)-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydropicen-2-yl]carbamoyl}amino)propanoate
InChI key:YDYVXFVSJXNEQS-WRZFNOOCSA-N

分子式:C33H46N2O5
分子量:550.74
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12C[C@@](C)(CC[C@]1(C)CC[C@]1(C)C3=CC=C4C(C)=C(O)C(=O)C=C4[C@]3(C)CC[C@@]21C)NC(=O)N[C@@H](C)C(=O)OC
SMILES:[H][C@@]12C[C@@](C)(CC[C@]1(C)CC[C@]1(C)C3=CC=C4C(C)=C(O)C(=O)C=C4[C@]3(C)CC[C@@]21C)NC(=O)N[C@@H](C)C(=O)OC

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