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Substance Name: Tigecycline, (4R)-
RN: 1422262-97-2
UNII: U98SS1SU9R
InChIKey: FPZLLRFZJZRHSY-RXEYFDPISA-N

Molecular Formula

  • C29-H39-N5-O8

Molecular Weight

  • 585.6541
 
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Names and Synonyms

Name of Substance

  • Tigecycline, (4R)-

Synonyms

  • 2-Naphthacenecarboxamide, 4,7-bis(dimethylamino)-9-((2-((1,1-dimethylethyl)amino)acetyl)amino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-, (4R,4aS,5aR,12aS)-
  • Tigecycline, (4R)-
  • UNII-U98SS1SU9R

Registry Numbers

CAS Registry Number

  • 1422262-97-2

FDA UNII

  • U98SS1SU9R

System Generated Number

  • 1422262972

Structure Descriptors

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

InChIKey

FPZLLRFZJZRHSY-RXEYFDPISA-N

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