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CHEBI:42531 - 5A-(3-FORMYLPHENYLSULFANYL)-DIHYDROBICYCLOMYCIN

Default Structure
ChEBI IDCHEBI:42531
ChEBI Name5A-(3-FORMYLPHENYLSULFANYL)-DIHYDROBICYCLOMYCIN
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC19H24N2O8S
Net Charge0
Average Mass440.474
Monoisotopic Mass440.12534
SMILES[H]OC([H])([H])[C@@](O[H])(C([H])([H])[H])[C@]([H])(O[H])[C@@]12OC([H])([H])C([H])([H])[C@@]([H])(C([H])([H])Sc3c([H])c([H])c([H])c(C([H])=O)c3[H])[C@@](O[H])(C(=O)N1[H])N([H])C2=O
InChIInChI=1S/C19H24N2O8S/c1-17(27,10-23)14(24)19-16(26)20-18(28,15(25)21-19)12(5-6-29-19)9-30-13-4-2-3-11(7-13)8-22/h2-4,7-8,12,14,23-24,27-28H,5-6,9-10H2,1H3,(H,20,26)(H,21,25)/t12-,14-,17-,18+,19-/m0/s1
InChIKeyLVFCJUVYCSPOOY-KRJMWWHISA-N
ChEBI Ontology
Outgoing Relation(s)
5A-(3-FORMYLPHENYLSULFANYL)-DIHYDROBICYCLOMYCIN (CHEBI:42531) is a unclassifieds (CHEBI:27189)
Synonyms  Source
3-[({(1S,5R,6R)-6-hydroxy-8,10-dioxo-1-[(1S,2S)-1,2,3-trihydroxy-2-methylpropyl]-2-oxa-7,9-diazabicyclo[4.2.2]dec-5-yl}methyl)sulfanyl]benzaldehydePDBeChem
5A-(3-FORMYLPHENYLSULFANYL)-DIHYDROBICYCLOMYCINPDBeChem
Manual XrefsDatabases
FPDPDBeChem