CHEBI:80047 - ECO 02301

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ChEBI Name ECO 02301 ChEBI ID CHEBI:80047 Stars This entity has been manually annotated by a third party. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C70H108N2O20 Net Charge 0 Average Mass 1297.60790 Monoisotopic Mass 1296.74954 InChI InChI=1S/C70H108N2O20/c1-46(27-20-16-12-8-5-6-11-15-19-23-35-64(86)72-65-60(83)36-37-61(65)84)66(87)48(3)59(82)33-21-17-13-9-7-10-14-18-22-34-63(92-70-69(90)68(89)67(88)49(4)91-70)47(2)62(85)45-58(81)44-57(80)42-53(76)31-25-30-52(75)41-56(79)43-55(78)40-51(74)29-24-28-50(73)39-54(77)32-26-38-71/h5-11,13-15,17-25,27,29,31,33,35,46-59,63,66-70,73-83,87-90H,12,16,26,28,30,32,34,36-45,71H2,1-4H3,(H,72,86)/b8-5+,9-7+,11-6+,14-10+,17-13+,19-15+,22-18+,27-20+,29-24+,31-25+,33-21+,35-23+/t46?,47?,48?,49-,50?,51?,52?,53?,54?,55?,56?,57?,58?,59?,63?,66?,67-,68+,69+,70-/m0/s1 InChIKey NLVFTSADLUSKGV-TUEZCROESA-N SMILES CC(\C=C\CC\C=C\C=C\C=C\C=C\C(=O)NC1=C(O)CCC1=O)C(O)C(C)C(O)\C=C\C=C\C=C\C=C\C=C\CC(O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O)C(C)C(=O)CC(O)CC(O)CC(O)\C=C\CC(O)CC(O)CC(O)CC(O)\C=C\CC(O)CC(O)CCCN ChEBI Ontology Outgoing ECO 02301 (CHEBI:80047) is a organic molecular entity (CHEBI:50860) Manual Xref Database C15717 KEGG COMPOUND View more database links