Products 1229002-07-6

CAS 1229002-07-6 appears in our catalog under these names: Tigecycline hydrate, Tigecycline hydrate, 99.00%, Tigecycline (hydrate), 99.51%. Offered by: Biosynth, Chemat, MedChemExpress. Available pack sizes: 5mg, 2mg, 100mg, 25mg, 10mg, 50 mg, 10 mg, 5 mg.

Structural formula: {0} (CAS {1})

(4S,4aS,5aR,12aR)-9-[[2-(tert-butylamino)acetyl]amino]-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrate (CAS 1229002-07-6) is a chemical compound with the molecular formula C29H41N5O9 and a molecular weight of 603.7 g/mol. IUPAC name: (4S,4aS,5aR,12aR)-9-[[2-(tert-butylamino)acetyl]amino]-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrate. InChIKey: SUGZODNQTKYJAW-KXLOKULZSA-N.

Identity
Molecular formulaC29H41N5O9
Molecular weight603.7 g/mol
IUPAC name(4S,4aS,5aR,12aR)-9-[[2-(tert-butylamino)acetyl]amino]-4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide;hydrate
InChIKeySUGZODNQTKYJAW-KXLOKULZSA-N
SMILESCC(C)(C)NCC(=O)NC1=CC(=C2C[C@H]3C[C@H]4[C@@H](C(=O)C(=C([C@]4(C(=O)C3=C(C2=C1O)O)O)O)C(=O)N)N(C)C)N(C)C.O

Computed by PubChem (NCBI)