2'''-acetyl-6'''-deamino-6'''-hydroxyneomycin C
Chemical Formula:
C25H51N5O15
Molecular Weight:
661.702 Daltons
Monoisotopic Mass:
661.3381659946 Daltons
SMILES:
CC(=O)NC1(C(OC(CO)C(O)C(O)1)OC4(C(C(OC3(C(C([N+])CC([N+])C(OC2(OC(C[N+])C(O)C(O)C([N+])2))3)O))OC4CO)O))
InChI:
1S/C25H47N5O15/c1-6(33)30-13-18(38)16(36)10(4-31)41-24(13)44-21-11(5-32)42-25(19(21)39)45-22-14(34)7(27)2-8(28)20(22)43-23-12(29)17(37)15(35)9(3-26)40-23/h7-25,31-32,34-39H,2-5,26-29H2,1H3,(H,30,33)/p+4/t7-,8+,9-,10-,11-,12-,13-,14+,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25+/m1/s1
InChIKey:
Databases
MetaCyc:
CPD-14168
PubChem (CID):
57339207
ChEBI:
65030
Seed:
cpd17708
MetaNetX:
MNXM9732
KEGG:
C17587