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CHEBI:209913 - [(3E,5E,7R,8S,12S,14E,16S)-21-chloro-8-hydroxy-7,22-dimethoxy-3,13,15-trimethyl-10,18-dioxo-11-oxa-9,19-diazatricyclo[18.3.1.18,12]pentacosa-1(24),3,5,14,20,22-hexaen-16-yl] carbamate

ChEBI IDCHEBI:209913
ChEBI Name[(3E,5E,7R,8S,12S,14E,16S)-21-chloro-8-hydroxy-7,22-dimethoxy-3,13,15-trimethyl-10,18-dioxo-11-oxa-9,19-diazatricyclo[18.3.1.18,12]pentacosa-1(24),3,5,14,20,22-hexaen-16-yl] carbamate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H36ClN3O8
Net Charge0
Average Mass578.062
Monoisotopic Mass577.21909
SMILESCOc1cc2cc(c1Cl)NC(=O)C[C@H](OC(N)=O)/C(C)=C/C(C)[C@@H]1C[C@@](O)(NC(=O)O1)[C@H](OC)/C=C/C=C(\C)C2
InChIInChI=1S/C28H36ClN3O8/c1-15-7-6-8-23(38-5)28(36)14-22(40-27(35)32-28)17(3)10-16(2)20(39-26(30)34)13-24(33)31-19-11-18(9-15)12-21(37-4)25(19)29/h6-8,10-12,17,20,22-23,36H,9,13-14H2,1-5H3,(H2,30,34)(H,31,33)(H,32,35)/b8-6+,15-7+,16-10+/t17?,20-,22-,23+,28-/m0/s1
InChIKeyYFUXHJDPOQWBIU-CUJMSCANSA-N
Species of MetaboliteComponentSourceComments
Amycolatopsis alba DSM 44262 (ncbitaxon:1125972) - PubMed (31299158)
ChEBI Ontology
Outgoing Relation(s)
[(3E,5E,7R,8S,12S,14E,16S)-21-chloro-8-hydroxy-7,22-dimethoxy-3,13,15-trimethyl-10,18-dioxo-11-oxa-9,19-diazatricyclo[18.3.1.18,12]pentacosa-1(24),3,5,14,20,22-hexaen-16-yl] carbamate (CHEBI:209913) is a methoxybenzenes (CHEBI:51683)
IUPAC Name 
[(3E,5E,7R,8S,12S,14E,16S)-21-chloro-8-hydroxy-7,22-dimethoxy-3,13,15-trimethyl-10,18-dioxo-11-oxa-9,19-diazatricyclo[18.3.1.18,12]pentacosa-1(24),3,5,14,20,22-hexaen-16-yl] carbamate