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Substance Name: Sarecycline [USAN:INN]
RN: 1035654-66-0
UNII: 94O110CX2E
InChIKey: PQJQFLNBMSCUSH-SBAJWEJLSA-N

Molecular Formula

  • C24-H29-N3-O8

Molecular Weight

  • 487.5061
 
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Names and Synonyms

Name of Substance

  • Sarecycline [USAN:INN]

Synonyms

  • P005672
  • Sarecycline
  • UNII-94O110CX2E

Systematic Names

  • (4S,4aS,5aR,12aS)-4-(dimethylamino)-3,10,12,12a-tetrahydroxy-7-((methoxymethylamino)methyl)-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
  • 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-7-((methoxymethylamino)methyl)-1,11-dioxo-, (4S,4aS,5aR,12aS)-

Registry Numbers

CAS Registry Number

  • 1035654-66-0

FDA UNII

  • 94O110CX2E

System Generated Number

  • 1035654660

Structure Descriptors

InChI

1S/C24H29N3O8/c1-26(2)18-13-8-11-7-12-10(9-27(3)35-4)5-6-14(28)16(12)19(29)15(11)21(31)24(13,34)22(32)17(20(18)30)23(25)33/h5-6,11,13,18,28,30-31,34H,7-9H2,1-4H3,(H2,25,33)/t11-,13-,18-,24-/m0/s1

InChIKey

PQJQFLNBMSCUSH-SBAJWEJLSA-N

Smiles

CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(c4C(=O)C3=C([C@@]2(C(=O)C(=C1O)C(=O)N)O)O)O)CN(C)OC