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CHEBI:203275 - Formamicin

ChEBI IDCHEBI:203275
ChEBI NameFormamicin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H72O13
Net Charge0
Average Mass809.047
Monoisotopic Mass808.49729
SMILESCCCCC[C@@H]1OCO[C@@]2(C)/C=C(C)/C=C/C(=O)O[C@H]([C@@H](C)[C@@H](O)[C@H](C)[C@@]3(O)C[C@@H](O[C@H]4C[C@@H](O)[C@H](O)[C@@H](C)O4)[C@H](C)[C@@H](C)O3)[C@@H](OC)/C=C/C=C(\C)C[C@H]1[C@@H]2O
InChIInChI=1S/C44H72O13/c1-11-12-13-16-34-32-20-25(2)15-14-17-35(51-10)41(56-37(46)19-18-26(3)22-43(9,42(32)49)53-24-52-34)28(5)39(47)29(6)44(50)23-36(27(4)30(7)57-44)55-38-21-33(45)40(48)31(8)54-38/h14-15,17-19,22,27-36,38-42,45,47-50H,11-13,16,20-21,23-24H2,1-10H3/b17-14+,19-18+,25-15+,26-22+/t27-,28+,29+,30-,31-,32-,33-,34+,35+,36-,38+,39-,40-,41-,42+,43+,44-/m1/s1
InChIKeyAUNKVZMKKDTMQP-AGCNVFKOSA-N
Species of MetaboliteComponentSourceComments
Saccharothrix (ncbitaxon:2071) - PubMed (9592565)
ChEBI Ontology
Outgoing Relation(s)
Formamicin (CHEBI:203275) is a macrolide (CHEBI:25106)
IUPAC Name 
(1S,2E,4E,8R,9S,10E,12E,15S,16S,20S)-8-[(2S,3R,4S)-4-[(2R,4R,5R,6R)-4-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-5,6-dimethyloxan-2-yl]-3-hydroxypentan-2-yl]-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxabicyclo[13.4.1]icosa-2,4,10,12-tetraen-6-one
Manual XrefsDatabases
4976805ChemSpider