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CHEBI:9414 - Tautomycin

ChEBI IDCHEBI:9414
ChEBI NameTautomycin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC41H66O13
Net Charge0
Average Mass766.966
Monoisotopic Mass766.45034
SMILESCO[C@H]([C@H](O)CC(=O)[C@@H](C)[C@@H](O)CC[C@@H](C)[C@@H]1O[C@]2(CC[C@@H](C)[C@H](CC[C@H](C)C(C)=O)O2)CC[C@@H]1C)[C@H](OC(=O)C[C@@H](O)C1=C(C)C(=O)OC1=O)C(C)C
InChIInChI=1S/C41H66O13/c1-21(2)36(51-34(47)20-31(45)35-27(8)39(48)52-40(35)49)38(50-10)32(46)19-30(44)26(7)29(43)13-11-24(5)37-25(6)16-18-41(54-37)17-15-23(4)33(53-41)14-12-22(3)28(9)42/h21-26,29,31-33,36-38,43,45-46H,11-20H2,1-10H3/t22-,23+,24+,25-,26-,29-,31+,32+,33-,36+,37-,38+,41+/m0/s1
InChIKeyRFCWHQNNCOJYTR-IRCAEPKSSA-N
ChEBI Ontology
Outgoing Relation(s)
Tautomycin (CHEBI:9414) is a carboxylic ester (CHEBI:33308)
Synonym  Source
TautomycinKEGG COMPOUND
Manual XrefsDatabases
C00017872KNApSAcK
C05372KEGG COMPOUND
Registry NumbersSources
CAS:109946-35-2KEGG COMPOUND