Tigecycline
Product Code
DRE-C17577000
CAS Number
Product Format
Neat
Lot Number
1367289
Expiry
2027-06-15
Molecular Formula
C29 H39 N5 O8
Molecular Weight
585.65
Product Categories
Dr. Ehrenstorfer, Pharmaceutical, Veterinary Compound & Metabolite Reference Materials
Product Type
Native/ParentAlternate CAS Number
Documentation
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Product Information
Analyte Data
Analyte Name
Tigecycline
CAS Number
220620-09-7
Molecular Formula
C29 H39 N5 O8
Molecular Weight
585.65
Accurate Mass
585.2799
SMILES
CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(cc(NC(=O)CNC(C)(C)C)c(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N)N(C)C
InChI
InChI=1S/C29H39N5O8/c1-28(2,3)31-11-17(35)32-15-10-16(33(4)5)13-8-12-9-14-21(34(6)7)24(38)20(27(30)41)26(40)29(14,42)25(39)18(12)23(37)19(13)22(15)36/h10,12,14,21,31,36,38-39,42H,8-9,11H2,1-7H3,(H2,30,41)(H,32,35)/t12-,14-,21-,29-/m0/s1
IUPAC
(4S,4aS,5aR,12aS)-9-[[2-(tert-butylamino)acetyl]amino]-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide
Alternate CAS Number
Hydrate: 1229002-07-6
Product Data
Storage Temperature
+4°C
Shipping Temperature
+20°C
Country of Origin
GERMANY
Product Format
Neat
