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CHEBI:203487 - Archazolid D

ChEBI IDCHEBI:203487
ChEBI NameArchazolid D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H72N2O13S
Net Charge0
Average Mass917.172
Monoisotopic Mass916.47551
SMILESCNC(=O)O[C@@H](CC(C)C)c1nc([C@H]2OC(=O)/C(C)=C\C/C(C)=C\[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](C)/C=C(CO)\C=C(C)/C=C\[C@@H](O)[C@H](C)[C@H](OC)/C(C)=C\C=C/[C@@H]2C)cs1
InChIInChI=1S/C48H72N2O13S/c1-26(2)19-38(62-48(58)49-10)45-50-35(25-64-45)44-30(6)14-12-13-29(5)43(59-11)33(9)36(53)18-16-27(3)20-34(23-51)22-32(8)37(21-28(4)15-17-31(7)46(57)63-44)60-47-42(56)41(55)40(54)39(24-52)61-47/h12-14,16-18,20-22,25-26,30,32-33,36-44,47,51-56H,15,19,23-24H2,1-11H3,(H,49,58)/b14-12-,18-16-,27-20-,28-21-,29-13-,31-17-,34-22+/t30-,32-,33-,36+,37+,38-,39+,40+,41-,42+,43+,44-,47+/m0/s1
InChIKeyPRYQWZDWIKKKKA-GAWLOLQLSA-N
Species of MetaboliteComponentSourceComments
Archangium violaceum (ncbitaxon:83451) - PubMed (17551213)
ChEBI Ontology
Outgoing Relation(s)
Archazolid D (CHEBI:203487) is a macrolide (CHEBI:25106)
IUPAC Name 
[(1S)-1-[4-[(2S,3S,4Z,6Z,8S,9S,10R,11Z,13Z,15E,17S,18S,19Z,22Z)-10-hydroxy-15-(hydroxymethyl)-8-methoxy-3,7,9,13,17,20,23-heptamethyl-24-oxo-18-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1-oxacyclotetracosa-4,6,11,13,15,19,22-heptaen-2-yl]-1,3-thiazol-2-yl]-3-methylbutyl] N-methylcarbamate