CHEBI:34813 - Leucomycin A13

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Leucomycin A13
ChEBI ID CHEBI:34813
Stars This entity has been manually annotated by a third party.
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Formula C41H69NO14
Net Charge 0
Average Mass 799.986
Monoisotopic Mass 799.47181
InChI InChI=1S/C41H69NO14/c1-10-11-13-18-31(46)54-39-27(5)52-33(23-41(39,6)49)55-36-26(4)53-40(35(48)34(36)42(7)8)56-37-28(19-20-43)21-24(2)29(44)17-15-12-14-16-25(3)51-32(47)22-30(45)38(37)50-9/h12,14-15,17,20,24-30,33-40,44-45,48-49H,10-11,13,16,18-19,21-23H2,1-9H3/b14-12+,17-15+/t24-,25-,26-,27+,28+,29+,30-,33+,34-,35-,36-,37+,38+,39+,40+,41-/m1/s1
InChIKey CUDHGRIZNLIHBG-TYBIZVFLSA-N
SMILES CCCCCC(=O)O[C@H]1[C@H](C)O[C@H](C[C@@]1(C)O)O[C@@H]1[C@@H](C)O[C@@H](O[C@H]2[C@@H](CC=O)C[C@@H](C)[C@@H](O)\C=C\C=C\C[C@@H](C)OC(=O)C[C@@H](O)[C@@H]2OC)[C@H](O)[C@H]1N(C)C
ChEBI Ontology
Outgoing Leucomycin A13 (CHEBI:34813) is a macrolide (CHEBI:25106)
Synonym Source
Leucomycin A13 KEGG COMPOUND
Manual Xref Database
C14063 KEGG COMPOUND
View more database links
Registry Number Type Source
78897-52-6 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014