EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:95336 - LSM-6702

ChEBI IDCHEBI:95336
ChEBI NameLSM-6702
Stars
DownloadsMolfile
Formula2C21H39N7O12
Net Charge0
Average Mass1163.160
Monoisotopic Mass1162.53134
SMILESCNC1C(OC2C(OC3C(O)C(O)C(N=C(N)N)C(O)C3N=C(N)N)OC(C)C2(O)C=O)OC(CO)C(O)C1O.CNC1C(OC2C(OC3C(O)C(O)C(N=C(N)N)C(O)C3N=C(N)N)OC(C)C2(O)C=O)OC(CO)C(O)C1O
InChIInChI=1S/2C21H39N7O12/c2*1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35/h2*4-18,26,29,31-36H,3H2,1-2H3,(H4,22,23,27)(H4,24,25,28)
InChIKeyWZNZNGWAURCKCZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-6702 (CHEBI:95336) is a amino cyclitol (CHEBI:61689)
LSM-6702 (CHEBI:95336) is a glycoside (CHEBI:24400)
Manual XrefsDatabases
LSM-6702LINCS