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CHEBI:197881 - Tenuecyclamide D

ChEBI IDCHEBI:197881
ChEBI NameTenuecyclamide D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22N6O5S3
Net Charge0
Average Mass522.634
Monoisotopic Mass522.08138
SMILESCc1oc2nc1C(=O)NCc1nc(cs1)C(=O)N[C@@H](CCS(C)=O)c1nc(cs1)C(=O)N[C@H]2C
InChIInChI=1S/C20H22N6O5S3/c1-9-19-26-15(10(2)31-19)18(29)21-6-14-23-12(7-32-14)17(28)24-11(4-5-34(3)30)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-,34?/m0/s1
InChIKeyILKYNUWKOMIMLZ-KMLOPCPQSA-N
Species of MetaboliteComponentSourceComments
Nostoc (ncbitaxon:1177) - PubMed (9784161)
ChEBI Ontology
Outgoing Relation(s)
Tenuecyclamide D (CHEBI:197881) is a azamacrocycle (CHEBI:52898)
Tenuecyclamide D (CHEBI:197881) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(4S,18S)-4,7-dimethyl-18-(2-methylsulinylethyl)-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
Manual XrefsDatabases
24718330ChemSpider