Seretide | Fluticasone/Salmeterol | Advair | Adoair | CAS 136112-01-1

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HIT ID:HIT214320482
Cas No:136112-01-1
常用名:Seretide
别名:Fluticasone/Salmeterol, Advair, Adoair
IUPAC:(1R,2R,3aS,3bS,5S,9aS,9bR,10S,11aS)-5,9b-difluoro-1-{[(fluoromethyl)sulfanyl]carbonyl}-10-hydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl propanoate; 4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)-2-(hydroxymethyl)phenol
IUPAC:(1R,2R,3aS,3bS,5S,9aS,9bR,10S,11aS)-5,9b-difluoro-1-{[(fluoromethyl)sulfanyl]carbonyl}-10-hydroxy-2,9a,11a-trimethyl-7-oxo-1H,2H,3H,3aH,3bH,4H,5H,7H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl propanoate; 4-(1-hydroxy-2-{[6-(4-phenylbutoxy)hexyl]amino}ethyl)-2-(hydroxymethyl)phenol
InChI key:YYAZJTUGSQOFHG-RZFXJYHSSA-N

分子式:C50H68F3NO9S
分子量:916.15
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1.[H][C@@]12C[C@@H](C)[C@](OC(=O)CC)(C(=O)SCF)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](F)C2=CC(=O)C=C[C@]12C |c:65,t:61|
SMILES:OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1.[H][C@@]12C[C@@H](C)[C@](OC(=O)CC)(C(=O)SCF)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])C[C@H](F)C2=CC(=O)C=C[C@]12C |c:65,t:61|

Seretide, a combination of fluticasone and salmeterol, controls symptoms of asthma and chronic obstructive pulmonary disease (COPD).

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