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CHEBI:227190 - Antalid

ChEBI IDCHEBI:227190
ChEBI NameAntalid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H37N3O5S
Net Charge0
Average Mass527.687
Monoisotopic Mass527.24539
SMILESCC[C@H](O)C[C@H]1OC(=O)[C@@H](Cc2ccccc2)NC(=O)c2csc(n2)[C@H](C(C)C)NC(=O)/C(C)=C\[C@H]1C
InChIInChI=1S/C28H37N3O5S/c1-6-20(32)14-23-17(4)12-18(5)25(33)31-24(16(2)3)27-30-22(15-37-27)26(34)29-21(28(35)36-23)13-19-10-8-7-9-11-19/h7-12,15-17,20-21,23-24,32H,6,13-14H2,1-5H3,(H,29,34)(H,31,33)/b18-12-/t17-,20+,21-,23-,24+/m1/s1
InChIKeyLMWDPSXUGSTACD-RAZPVMKYSA-N
Species of MetaboliteComponentSourceComments
Polyangiumspecies (ncbitaxon:57) - PubMed (27220069)
ChEBI Ontology
Outgoing Relation(s)
Antalid (CHEBI:227190) is a lactam (CHEBI:24995)
Antalid (CHEBI:227190) is a macrolide (CHEBI:25106)
IUPAC Name 
(4R,7R,8R,9E,13S)-4-benzyl-7-[(2S)-2-hydroxybutyl]-8,10-dimethyl-13-propan-2-yl-6-oxa-15-thia-3,12,17-triazabicyclo[12.2.1]heptadeca-1(16),9,14(17)-triene-2,5,11-trione
Manual XrefsDatabases
58825846ChemSpider