N6'-acetylkanamycin-B

Chemical Formula:

C₂₀H₄₃N₅O₁₁

Molecular Weight:

529.587 Daltons

Monoisotopic Mass:

529.2959072494 Daltons

SMILES:

CC(=O)NCC3(OC(OC2(C([N+])CC([N+])C(OC1(OC(CO)C(O)C([N+])C(O)1))C(O)2))C([N+])C(O)C(O)3)

InChI:

1S/C20H39N5O11/c1-5(27)25-3-8-13(29)14(30)11(24)19(33-8)35-17-6(21)2-7(22)18(16(17)32)36-20-15(31)10(23)12(28)9(4-26)34-20/h6-20,26,28-32H,2-4,21-24H2,1H3,(H,25,27)/p+4/t6-,7+,8+,9+,10-,11+,12+,13+,14+,15+,16-,17+,18-,19+,20+/m0/s1

InChIKey:

JVNRAWAXQAGKBK-HLIGCJFYSA-R

Databases

MetaCyc: N6-ACETYLKANAMYCIN-B

ChEBI: 58390

PubChem (CID): 25246052

KEGG: C03154

Seed: cpd02019

MetaNetX: MNXM4683