Name: Safracin B
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT214317391
Cas No:87578-99-2
常用名:Safracin B
别名:EM-5519, EM5519, EM 5519, Antibiotic Y 16482-alpha, Antibiotic EM 5519
别名:EM-5519, EM5519, EM 5519, Antibiotic Y 16482-alpha, Antibiotic EM 5519
IUPAC:(2S)-2-amino-N-{[(1R,2S,10R,12S,13S)-12,19-dihydroxy-7,18-dimethoxy-6,17,21-trimethyl-5,8-dioxo-11,21-diazapentacyclo[11.7.1.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-4(9),6,15(20),16,18-pentaen-10-yl]methyl}propanamide
IUPAC:(2S)-2-amino-N-{[(1R,2S,10R,12S,13S)-12,19-dihydroxy-7,18-dimethoxy-6,17,21-trimethyl-5,8-dioxo-11,21-diazapentacyclo[11.7.1.0^{2,11}.0^{4,9}.0^{15,20}]henicosa-4(9),6,15(20),16,18-pentaen-10-yl]methyl}propanamide
InChI key:GKUZBRIJGIGFKC-DODRDYGUSA-N

分子式:C28H36N4O7
分子量:540.617
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:[H][C@@]12Cc3cc(C)c(OC)c(O)c3[C@@]([H])(N1C)[C@]1([H])CC3=C([C@H](CNC(=O)[C@H](C)N)N1[C@H]2O)C(=O)C(OC)=C(C)C3=O |c:22,t:41,TLB:10:12:15:17.30.31,4:3:15:17.30.31,THB:19:17:15:2.3.12,32:31:15:2.3.12|
SMILES:[H][C@@]12Cc3cc(C)c(OC)c(O)c3[C@@]([H])(N1C)[C@]1([H])CC3=C([C@H](CNC(=O)[C@H](C)N)N1[C@H]2O)C(=O)C(OC)=C(C)C3=O |c:22,t:41,TLB:10:12:15:17.30.31,4:3:15:17.30.31,THB:19:17:15:2.3.12,32:31:15:2.3.12|

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