Term: | Ganoweberianone A |
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Accession: | CHEBI:194571
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Synonyms: | exact_synonym: | [(2R,3S,6R)-1,2-dihydroxy-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]heptan-3-yl] (2S,6R)-6-[(5R,10S,13R,14R,15R,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3,7,11-trioxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoate |
| related_synonym: | Formula=C60H88O10; InChI=1S/C60H88O10/c1-33(37-19-25-57(11)39-16-17-43-52(4,5)45(65)21-23-54(43,8)38(39)20-26-56(37,57)10)15-18-48(59(13,69)32-61)70-51(68)35(3)28-36(62)27-34(2)40-29-47(67)60(14)50-41(63)30-44-53(6,7)46(66)22-24-55(44,9)49(50)42(64)31-58(40,60)12/h16,20,33-35,37,40,43-44,47-48,61,67,69H,15,17-19,21-32H2,1-14H3/t33-,34-,35+,37-,40-,43+,44+,47-,48+,54-,55+,56-,57+,58-,59-,60+/m1/s1; InChIKey=KOHPJQAINZLZJM-ADOIXGOQSA-N; SMILES=C[C@@](CC[C@@]([H])([C@@](C)(CO)O)OC([C@@](C)(CC(C[C@](C)([H])[C@]1(C[C@]([H])([C@@]2(C)C=3C(C[C@@]4([H])C(C)(C)C(CC[C@]4(C)C3C(C[C@]12C)=O)=O)=O)O)[H])=O)[H])=O)([H])[C@]5(CC[C@@]6(C)C7=CC[C@@]8([H])C(C)(C)C(CC[C@]8(C)C7=CC[C@]56C)=O)[H] |
| xref: | LIPID_MAPS_instance:LMST01010420 |
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