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CHEBI:82005 - Spiramycin III

ChEBI IDCHEBI:82005
ChEBI NameSpiramycin III
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC46H78N2O15
Net Charge0
Average Mass899.129
Monoisotopic Mass898.54022
SMILESCCC(=O)O[C@@H]1CC(=O)O[C@H](C)C/C=C/C=C/[C@H](O[C@H]2CC[C@H](N(C)C)[C@@H](C)O2)[C@H](C)C[C@H](CC=O)[C@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](O)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@H]1OC
InChIInChI=1S/C46H78N2O15/c1-13-35(50)60-34-24-36(51)56-27(3)17-15-14-16-18-33(61-37-20-19-32(47(8)9)28(4)57-37)26(2)23-31(21-22-49)42(43(34)55-12)63-45-40(52)39(48(10)11)41(29(5)59-45)62-38-25-46(7,54)44(53)30(6)58-38/h14-16,18,22,26-34,37-45,52-54H,13,17,19-21,23-25H2,1-12H3/b15-14+,18-16+/t26-,27-,28-,29-,30+,31+,32+,33+,34-,37+,38+,39-,40-,41-,42+,43+,44+,45+,46-/m1/s1
InChIKeyHSZLKTCKAYXVBX-LYIMTGTFSA-N
ChEBI Ontology
Outgoing Relation(s)
Spiramycin III (CHEBI:82005) is a amino oligosaccharide (CHEBI:22483)
Synonyms  Source
Spiramycin 3DrugCentral
Foromacidin CDrugCentral
Foromacidine CDrugCentral
Spiramycin CDrugCentral
Manual XrefsDatabases
C18844KEGG COMPOUND
2473DrugCentral
Registry NumbersSources
CAS:24916-52-7KEGG COMPOUND