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CHEBI:34948 - Rifamycin S

ChEBI IDCHEBI:34948
ChEBI NameRifamycin S
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC37H45NO12
Net Charge0
Average Mass695.762
Monoisotopic Mass695.29418
SMILESCO[C@H]1/C=C/O[C@@]2(C)Oc3c(C)c(O)c4c(c3C2=O)C(=O)C=C(NC(=O)/C(C)=C\C=C\[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](OC(C)=O)[C@@H]1C)C4=O
InChIInChI=1S/C37H45NO12/c1-16-11-10-12-17(2)36(46)38-23-15-24(40)26-27(32(23)44)31(43)21(6)34-28(26)35(45)37(8,50-34)48-14-13-25(47-9)18(3)33(49-22(7)39)20(5)30(42)19(4)29(16)41/h10-16,18-20,25,29-30,33,41-43H,1-9H3,(H,38,46)/b11-10+,14-13+,17-12-/t16-,18+,19+,20+,25-,29-,30+,33+,37-/m0/s1
InChIKeyBTVYFIMKUHNOBZ-ODRIEIDWSA-N
ChEBI Ontology
Outgoing Relation(s)
Rifamycin S (CHEBI:34948) is a organic molecular entity (CHEBI:50860)
Synonym  Source
Rifamycin SKEGG COMPOUND
Manual XrefsDatabases
C14540KEGG COMPOUND
Registry NumbersSources
CAS:13553-79-2KEGG COMPOUND