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CHEBI:213099 - Chlokamycin

ChEBI IDCHEBI:213099
ChEBI NameChlokamycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H41ClN2O7
Net Charge0
Average Mass577.118
Monoisotopic Mass576.26023
SMILESCOC(C)[C@H]1[C@@H]2[C@H](Cl)[C@H](O)C3C(C[C@H]4/C=C/C(O)=C5C(=O)N[C@H](C5=O)[C@@H](O)CCNC(=O)/C=C\C[C@H]34)[C@H]2C[C@H]1C
InChIInChI=1S/C30H41ClN2O7/c1-13-11-17-18-12-15-7-8-19(34)25-29(38)27(33-30(25)39)20(35)9-10-32-21(36)6-4-5-16(15)23(18)28(37)26(31)24(17)22(13)14(2)40-3/h4,6-8,13-18,20,22-24,26-28,34-35,37H,5,9-12H2,1-3H3,(H,32,36)(H,33,39)/b6-4-,8-7+,25-19?/t13-,14?,15-,16+,17-,18?,20+,22+,23?,24-,26+,27+,28-/m1/s1
InChIKeyMUNZKDKGKGYXPU-DYCLSPEGSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - DOI (10.1177/1934578x1701200818)
ChEBI Ontology
Outgoing Relation(s)
Chlokamycin (CHEBI:213099) is a azamacrocycle (CHEBI:52898)
Chlokamycin (CHEBI:213099) is a keratan 6'-sulfate (CHEBI:18331)
IUPAC Name 
(3E,5S,8R,10R,11R,12R,13S,14R,16S,18Z,24S,25S)-13-chloro-2,14,24-trihydroxy-11-(1-methoxyethyl)-10-methyl-21,26-diazapentacyclo[23.2.1.05,16.07,15.08,12]octacosa-1,3,18-triene-20,27,28-trione