Term: | 13-Demethoxy-13-methylascomycin |
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Accession: | CHEBI:199438
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Synonyms: | exact_synonym: | (1R,9S,12S,13R,14S,17R,18Z,21S,23S,24S,25S,27R)-17-ethyl-1,14-dihydroxy-12-[(E)-1-[(1R,3R,4R)-4-hydroxy-3-methoxycyclohexyl]prop-1-en-2-yl]-23-methoxy-13,19,21,25,27-pentamethyl-11,28-dioxa-4-azatricyclo[22.3.1.04,9]octacos-18-ene-2,3,10,16-tetrone |
| related_synonym: | Formula=C43H69NO11; InChI=1S/C43H69NO11/c1-10-31-18-24(2)17-25(3)19-37(53-9)39-26(4)20-28(6)43(51,55-39)40(48)41(49)44-16-12-11-13-32(44)42(50)54-38(29(7)34(46)23-35(31)47)27(5)21-30-14-15-33(45)36(22-30)52-8/h18,21,25-26,28-34,36-39,45-46,51H,10-17,19-20,22-23H2,1-9H3/b24-18-,27-21+/t25-,26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38+,39-,43+/m0/s1; InChIKey=FMXJJPHNGGRBTC-ZFYDLYRZSA-N; SMILES=O=C1N2[C@H](C(=O)O[C@H](/C(=C/[C@H]3C[C@@H](OC)[C@H](O)CC3)/C)[C@@H]([C@@H](O)CC(=O)[C@H](CC)C=C(C[C@@H](C[C@@H]([C@H]4O[C@](C1=O)(O)[C@@H](C[C@@H]4C)C)OC)C)C)C)CCCC2 |
| xref: | Chemspider:78439602 |
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