Name: Tigecycline mesylate
Rating: 5 (10 reviews)

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HIT ID:HIT212709387
Cas No:1135871-27-0
常用名:Tigecycline mesylate
别名:甲磺酸替加环素
IUPAC:(4S,4aS,5aR,12aS)-9-[(Z)-[2-(tert-butylamino)-1-hydroxyethylidene]amino]-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboximidic acid; methanesulfonic acid
IUPAC:(4S,4aS,5aR,12aS)-9-[(Z)-[2-(tert-butylamino)-1-hydroxyethylidene]amino]-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboximidic acid; methanesulfonic acid
InChI key:JYPFQXOJRDSKSF-KXLOKULZSA-N

分子式:C30H43N5O11S
分子量:681.76
氢键供体数 (HBD):8
氢键受体数 (HBA):13
LogP:-5.641278
SMILES:CS(O)(=O)=O.[H][C@@]12Cc3c(cc(\N=C(/O)CNC(C)(C)C)c(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(O)=N)=C(O)[C@@]([H])(N(C)C)[C@]1([H])C2)N(C)C |t:27,37|
SMILES:CS(O)(=O)=O.[H][C@@]12Cc3c(cc(\N=C(/O)CNC(C)(C)C)c(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(O)=N)=C(O)[C@@]([H])(N(C)C)[C@]1([H])C2)N(C)C |t:27,37|

Tigecycline mesylate is a first-in-class, broad-spectrum antibiotic. It also has activity against antibiotic-resistant organisms.

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