arbekacin 2''-phosphate
Chemical Formula:
C22H48N6O13P
Molecular Weight:
635.627 Daltons
Monoisotopic Mass:
637.3173472335001 Daltons
SMILES:
C([N+])CC(O)C(=O)NC2(C(C(C(OC1(OC(CCC1[N+])C[N+]))C([N+])C2)O)OC3(OC(C(C(C(OP([O-])(=O)[O-])3)[N+])O)CO))
InChI:
1S/C22H45N6O13P/c23-4-3-12(30)20(33)28-11-5-10(26)17(39-21-9(25)2-1-8(6-24)37-21)16(32)18(11)40-22-19(41-42(34,35)36)14(27)15(31)13(7-29)38-22/h8-19,21-22,29-32H,1-7,23-27H2,(H,28,33)(H2,34,35,36)/p+3/t8-,9+,10-,11+,12-,13+,14-,15+,16-,17+,18-,19+,21+,22+/m0/s1
InChIKey:
Databases
MetaCyc:
CPD-18050
PubChem (CID):
91820068
MetaNetX:
MNXM148947