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CHEBI:94694 - LSM-5735

ChEBI IDCHEBI:94694
ChEBI NameLSM-5735
Stars
DownloadsMolfile
FormulaC44H69NO12
Net Charge0
Average Mass804.031
Monoisotopic Mass803.48198
SMILESC=CC[C@@H]1C=C(C)C[C@H](C)C[C@H](OC)[C@H]2O[C@](O)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@H](C(C)=C[C@@H]3CC[C@@H](O)[C@H](OC)C3)[C@H](C)[C@@H](O)CC1=O)[C@H](C)C[C@@H]2OC
InChIInChI=1S/C44H69NO12/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44-/m0/s1
InChIKeyQJJXYPPXXYFBGM-WEHHIERPSA-N
ChEBI Ontology
Outgoing Relation(s)
LSM-5735 (CHEBI:94694) is a lactam (CHEBI:24995)
LSM-5735 (CHEBI:94694) is a macrolide (CHEBI:25106)
Manual XrefsDatabases
LSM-5735LINCS