4-methylamino-4-de(dimethylamino)anhydrotetracycline

Chemical Formula:

C₂₁H₂₀N₂O₇

Molecular Weight:

412.398 Daltons

Monoisotopic Mass:

413.1348760392 Daltons

SMILES:

CC1(C4(=C(C(O)=C2(C(=O)C3(O)(C(=O)C(C(=O)N)=C([O-])C([N+]C)[CH](CC=12)3)))C(O)=CC=C4))

InChI:

1S/C21H20N2O7/c1-7-8-4-3-5-11(24)12(8)16(25)13-9(7)6-10-15(23-2)17(26)14(20(22)29)19(28)21(10,30)18(13)27/h3-5,10,15,23-26,30H,6H2,1-2H3,(H2,22,29)/t10-,15-,21-/m0/s1

InChIKey:

IIHPMGDKNZPGON-QYAMTVPHSA-N

Synonyms

(4S,4aS,12aS)-3,10,11,12a-tetrahydroxy-6-methyl-4-(methylamino)-1,12-dioxo-4a,5-dihydro-4H-tetracene-2-carboxamide

Databases

MetaCyc: CPD-19271

ChEBI: 133696

PubChem (CID): 122198284

MetaNetX: MNXM162457

KEGG: C21436