hygromycin-B

Chemical Formula:

C₂₀H₄₀N₃O₁₃

Molecular Weight:

530.548 Daltons

Monoisotopic Mass:

530.2561133869 Daltons

SMILES:

C[N+]C4(CC([N+])C(O)C(OC2(OC(CO)C(O)C3(OC1(OC(C([N+])CO)C(O)C(O)C(O)1)(OC23))))C(O)4)

InChI:

1S/C20H37N3O13/c1-23-7-2-5(21)9(26)15(10(7)27)33-19-17-16(11(28)8(4-25)32-19)35-20(36-17)18(31)13(30)12(29)14(34-20)6(22)3-24/h5-19,23-31H,2-4,21-22H2,1H3/p+3/t5-,6-,7+,8-,9+,10-,11+,12+,13-,14?,15-,16+,17+,18+,19+,20?/m1/s1

InChIKey:

GRRNUXAQVGOGFE-CFHGZVLNSA-Q

Synonyms

antibiotic A-396-II

Databases

MetaCyc: HYGROMYCIN-B

ChEBI: 16976

HMDB: HMDB34229

PubChem (CID): 25245467

KEGG: C01925

CAS: 31282-04-9

MetaNetX: MNXM2381