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Substance Name: Eravacycline dihydrochloride [USAN]
RN: 1334714-66-7
UNII: WK1NMH89VJ
InChIKey: JYCNMRVZELJVAW-RZVFYPHASA-N

Note

  • Has antibacterial activity.

Molecular Weight

  • 631.4817
 
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Names and Synonyms

Name of Substance

  • Eravacycline dihydrochloride [USAN]

Synonyms

  • Eravacycline dihydrochloride
  • TP-434
  • TP-434-046
  • UNII-WK1NMH89VJ

Systematic Names

  • (4S,4aS,5aR,12aS)-4-(dimethylamino)-7-fluoro-3,10,12,12a-tetrahydroxy-1,11-dioxo-9-((pyrrolidin-1-ylacetyl)amino)-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide dihydrochloride
  • 1-Pyrrolidineacetamide, N-((5aR,6aS,7S,10aS)-9-(aminocarbonyl)-7-(dimethylamino)-4-fluoro-5,5a,6,6a,7,10,10a,12-octahydro-1,8,10a,11-tetrahydroxy-10,12-dioxo-2-naphthacenyl)-, hydrochloride (1:2)

Registry Numbers

CAS Registry Number

  • 1334714-66-7

FDA UNII

  • WK1NMH89VJ

System Generated Number

  • 1334714667

Structure Descriptors

InChI

1S/C27H31FN4O8.2ClH/c1-31(2)20-13-8-11-7-12-14(28)9-15(30-16(33)10-32-5-3-4-6-32)21(34)18(12)22(35)17(11)24(37)27(13,40)25(38)19(23(20)36)26(29)39;;/h9,11,13,20,34,36-37,40H,3-8,10H2,1-2H3,(H2,29,39)(H,30,33);2*1H/t11-,13-,20-,27-;;/m0../s1

InChIKey

JYCNMRVZELJVAW-RZVFYPHASA-N

Smiles

Cl.Cl.CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(F)cc(NC(=O)CN5CCCC5)c(O)c4C(=O)C3=C(O)[C@]2(O)C(=O)C(=C1O)C(=O)N