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CHEBI:201363 - Oligomycin F

ChEBI IDCHEBI:201363
ChEBI NameOligomycin F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC46H76O11
Net Charge0
Average Mass805.103
Monoisotopic Mass804.53876
SMILESCCC1/C=C/C=C/C[C@H](C)C(O)[C@](C)(O)C(=O)[C@H](C)[C@@H](O)[C@H](C)C(=O)[C@H](C)[C@@H](O)[C@H](C)/C=C/C(=O)O[C@H]2[C@@H](C)[C@@H](CC1)O[C@@]1(CC[C@@H](C)C(C[C@@H](O)CC)O1)[C@@H]2C
InChIInChI=1S/C46H76O11/c1-12-34-18-16-14-15-17-28(5)43(52)45(11,54)44(53)32(9)41(51)31(8)40(50)30(7)39(49)27(4)19-22-38(48)55-42-29(6)36(21-20-34)56-46(33(42)10)24-23-26(3)37(57-46)25-35(47)13-2/h14-16,18-19,22,26-37,39,41-43,47,49,51-52,54H,12-13,17,20-21,23-25H2,1-11H3/b15-14+,18-16+,22-19+/t26-,27-,28+,29+,30-,31-,32-,33-,34?,35+,36-,37?,39+,41+,42+,43?,45+,46-/m1/s1
InChIKeyBBXPKWAURBGKEO-ZWOLTWBCSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (8226311)
ChEBI Ontology
Outgoing Relation(s)
Oligomycin F (CHEBI:201363) is a macrolide (CHEBI:25106)
IUPAC Name 
(1S,4E,5'R,6R,7S,8R,10S,11S,12R,14S,16S,18E,20E,25R,27S,28R,29S)-22-ethyl-7,11,14,15-tetrahydroxy-6'-[(2S)-2-hydroxybutyl]-5',6,8,10,12,14,16,28,29-nonamethylspiro[2,26-dioxabicyclo[23.3.1]nonacosa-4,18,20-triene-27,2'-oxane]-3,9,13-trione