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CHEBI:222849 - Lobophorin A

ChEBI IDCHEBI:222849
ChEBI NameLobophorin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC61H92N2O19
Net Charge0
Average Mass1157.402
Monoisotopic Mass1156.62943
SMILESCOC(=O)N[C@@H]1[C@H](C)O[C@@H](OC2C/C=C(/C)[C@H]3C=C[C@H]4[C@H](O[C@@H]5C[C@@H](O[C@@H]6C[C@@H](O)[C@@H](O[C@@H]7C[C@@H](O)[C@@H](OC)[C@H](C)O7)[C@H](C)O6)[C@@H](O)[C@H](C)O5)[C@H](C)C[C@@H](C)[C@@H]4[C@@]3(C)/C(O)=C3/C(=O)OC4(C[C@H](C)C(CO)=C[C@H]4C=C2C)C3=O)C[C@@]1(C)N
InChIInChI=1S/C61H92N2O19/c1-27-14-17-42(78-47-25-59(10,62)54(35(9)77-47)63-58(71)73-13)28(2)19-37-20-36(26-64)31(5)24-61(37)56(69)48(57(70)82-61)55(68)60(11)39(27)16-15-38-49(60)29(3)18-30(4)51(38)80-46-23-43(50(67)32(6)74-46)79-44-22-41(66)53(34(8)76-44)81-45-21-40(65)52(72-12)33(7)75-45/h14-16,19-20,29-35,37-47,49-54,64-68H,17-18,21-26,62H2,1-13H3,(H,63,71)/b27-14-,28-19?,55-48-/t29-,30-,31+,32+,33+,34+,35+,37-,38-,39-,40-,41-,42?,43-,44-,45-,46-,47+,49+,50+,51-,52+,53+,54-,59-,60+,61?/m1/s1
InChIKeyBFIFMYVVBKSDFE-SRGKFFENSA-N
Species of MetaboliteComponentSourceComments
Actinomycesspecies (ncbitaxon:29317) - PubMed (10450970)
ChEBI Ontology
Outgoing Relation(s)
Lobophorin A (CHEBI:222849) is a sesterterpenoid (CHEBI:26660)