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CHEBI:226980 - Nostocyclamide M

ChEBI IDCHEBI:226980
ChEBI NameNostocyclamide M
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22N6O4S3
Net Charge0
Average Mass506.635
Monoisotopic Mass506.08647
SMILESCSCC[C@H]1NC(=O)c2csc(n2)CNC(=O)c2nc(oc2C)[C@H](C)NC(=O)c2csc1n2
InChIInChI=1S/C20H22N6O4S3/c1-9-19-26-15(10(2)30-19)18(29)21-6-14-23-12(7-32-14)17(28)24-11(4-5-31-3)20-25-13(8-33-20)16(27)22-9/h7-9,11H,4-6H2,1-3H3,(H,21,29)(H,22,27)(H,24,28)/t9-,11+/m0/s1
InChIKeyDMFUPHMBLSJHNR-GXSJLCMTSA-N
Species of MetaboliteComponentSourceComments
Nostoc (ncbitaxon:1177) - DOI (10.1016/s0031-9422(00)00470-2)
ChEBI Ontology
Outgoing Relation(s)
Nostocyclamide M (CHEBI:226980) is a azamacrocycle (CHEBI:52898)
Nostocyclamide M (CHEBI:226980) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(4S,18R)-4,7-dimethyl-18-(2-methylsulanylethyl)-6-oxa-13,20-dithia-3,10,17,22,23,24-hexazatetracyclo[17.2.1.15,8.112,15]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaene-2,9,16-trione
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