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CHEBI:203569 - Promomycin

ChEBI IDCHEBI:203569
ChEBI NamePromomycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H74O13
Net Charge0
Average Mass799.052
Monoisotopic Mass798.51294
SMILESCOC1[C@@H](C)[C@@](C)(O)O[C@H]([C@H]2C[C@H](C)[C@H]([C@]3(C)CC[C@H]([C@]4(C)CC[C@]5(C[C@H](OC)[C@@H](C)[C@@H]([C@@H](C)[C@H]6O[C@@](O)([C@H](C)C(=O)O)[C@H](C)[C@@H](OC)[C@H]6C)O5)O4)O3)O2)[C@H]1C
InChIInChI=1S/C43H74O13/c1-21-19-29(36-25(5)34(49-13)26(6)41(11,46)53-36)51-37(21)40(10)16-15-31(52-40)39(9)17-18-42(56-39)20-30(48-12)22(2)32(54-42)23(3)33-24(4)35(50-14)27(7)43(47,55-33)28(8)38(44)45/h21-37,46-47H,15-20H2,1-14H3,(H,44,45)/t21-,22+,23+,24-,25-,26+,27+,28+,29+,30-,31+,32-,33+,34?,35-,36-,37+,39-,40-,41-,42+,43+/m0/s1
InChIKeyLJJGQEWDYNPVSH-WCGOFJCCSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (20571515)
ChEBI Ontology
Outgoing Relation(s)
Promomycin (CHEBI:203569) is a ketal (CHEBI:59777)
IUPAC Name 
(2S)-2-[(2R,3R,4S,5R,6S)-2-hydroxy-6-[(1S)-1-[(2S,5R,7S,8R,9S)-2-[(2R,5S)-5-[(2R,3S,5R)-5-[(2S,3S,5R,6S)-6-hydroxy-4-methoxy-3,5,6-trimethyloxan-2-yl]-3-methyloxolan-2-yl]-5-methyloxolan-2-yl]-7-methoxy-2,8-dimethyl-1,10-dioxaspiro[4.5]decan-9-yl]ethyl]-4-methoxy-3,5-dimethyloxan-2-yl]propanoic acid
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