Chemical Compound

(1S,2R,3S,3'aS,4'R,6S,7'R,9'R,11'R,13'R,15'R,15'aR)-3-{[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl](methyl)amino}-4'-ethyl-2-hydroxy-11'-methoxy-3'a,7',9',11',13',15'-hexamethyl-1'-(4-phenylbutyl)-tetradecahydro-7,8-dioxaspiro[bicyclo[3.2.1]octane-6,10'-oxacyclotetradeca[4,3-d][1,3]oxazole]-2',6',8',14'-tetrone

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(1S,2R,3S,3'aS,4'R,6S,7'R,9'R,11'R,13'R,15'R,15'aR)-3-{[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl](methyl)amino}-4'-ethyl-2-hydroxy-11'-methoxy-3'a,7',9',11',13',15'-hexamethyl-1'-(4-phenylbutyl)-tetradecahydro-7,8-dioxaspiro[bicyclo[3.2.1]octane-6,10'-oxacyclotetradeca[4,3-d][1,3]oxazole]-2',6',8',14'-tetrone 结构式
Primary record

(1S,2R,3S,3'aS,4'R,6S,7'R,9'R,11'R,13'R,15'R,15'aR)-3-{[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl](methyl)amino}-4'-ethyl-2-hydroxy-11'-methoxy-3'a,7',9',11',13',15'-hexamethyl-1'-(4-phenylbutyl)-tetradecahydro-7,8-dioxaspiro[bicyclo[3.2.1]octane-6,10'-oxacyclotetradeca[4,3-d][1,3]oxazole]-2',6',8',14'-tetrone

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
177390391
SMILES
CCC1[C@@]2([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@]3([C@H](C(=O)[C@H](C(=O)O1)C)C)C4C[C@@H]([C@H]([C@@H](O4)O3)O)N(C)CC5=C(N(N=C5C)C6=CC=CC=C6)Cl)(C)OC)C)C)N(C(=O)O2)CCCCC7=CC=CC=C7)C
Canonical SMILES
CCC1OC(=O)[C@H](C)C(=O)[C@H](C)[C@@]2(O[C@@H]3OC2C[C@H](N(C)Cc2c(C)nn(-c4ccccc4)c2Cl)[C@H]3O)[C@](C)(OC)C[C@@H](C)C(=O)[C@H](C)[C@H]2N(CCCCc3ccccc3)C(=O)O[C@]12C

名称与同义词

  • J1.726.176B
  • (1S,2R,3S,3'aS,4'R,6S,7'R,9'R,11'R,13'R,15'R,15'aR)-3-{[(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methyl](methyl)amino}-4'-ethyl-2-hydroxy-11'-methoxy-3'a,7',9',11',13',15'-hexamethyl-1'-(4-phenylbutyl)-tetradecahydro-7,8-dioxaspiro[bicyclo[3.2.1]octane-6,10'-oxacyclotetradeca[4,3-d][1,3]oxazole]-2',6',8',14'-tetrone
  • 3-Oxo-3 -N-(1-phenyl-3-methyl-5-chloro-1H-pyrazole-4-ylmethyl)-6-O-methyl-11,12-O-(4-phenylbutyliminocarbonyl)-3-des(3-O,3-C-dimethyl-2,6-dideoxy-alpha-L-ribo-hexopyranosyloxy)-3 -N-demethyl-5,5 -cyclo-6 -nor-11-deoxyerythromycin