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CHEBI:40817 - 9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY-6-DEMETHYL-TETRACYCLINE

Default Structure
ChEBI IDCHEBI:40817
ChEBI Name9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY-6-DEMETHYL-TETRACYCLINE
Stars
DownloadsMolfile
FormulaC25H30N4O8
Net Charge0
Average Mass514.535
Monoisotopic Mass514.20636
SMILES[H]OC1=C2C(=O)c3c(O[H])c(N([H])C(=O)C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c([H])c([H])c3C([H])([H])[C@@]2([H])C([H])([H])[C@]2([H])[C@@]1(O[H])C(=O)C(C(=O)N([H])[H])=C(O[H])[C@@]2([H])N(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C25H30N4O8/c1-28(2)9-14(30)27-13-6-5-10-7-11-8-12-18(29(3)4)21(33)17(24(26)36)23(35)25(12,37)22(34)16(11)20(32)15(10)19(13)31/h5-6,11-12,18,31,33-34,37H,7-9H2,1-4H3,(H2,26,36)(H,27,30)/t11-,12-,18-,25-/m0/s1
InChIKeyOAZYAPOSQALFER-CLPWGHEBSA-N
ChEBI Ontology
Outgoing Relation(s)
9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY-6-DEMETHYL-TETRACYCLINE (CHEBI:40817) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(4S,4aS,5aR,12aS)-4-(dimethylamino)-9-[(N,N-dimethylglycyl)amino]-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamidePDBeChem
9-(N,N-DIMETHYLGLYCYLAMIDO)-6-DEOXY-6-DEMETHYL-TETRACYCLINEPDBeChem
Manual XrefsDatabases
ATCPDBeChem