Term: | Azaspiracid-7 |
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Accession: | CHEBI:145161
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Synonyms: | exact_synonym: | (E)-3-hydroxy-5-((2S,3aR,5R,5'R,6R,6''S,7aR)-2-((R)-hydroxy((2R,3R,5S,6S)-2-hydroxy-3,5-dimethyl-6-(3-((2S,3S,3a'R,5R,5'S,7'S,9'R,9a'R)-3,5,7'-trimethylhexahydrospiro[piperidine-2,2'-[5,9]epoxyfuro[3,2-b]oxocin]-5'(3'H)-yl)prop-1-en-2-yl)tetrahydro-2H-pyran-2-yl)methyl)-6-methyl-2,3,3a,3',3'',4',6,6'',7,7a-decahydrodispiro[furo[3,2-b]pyran-5,2'-furan-5',2''-pyran]-6''-yl)pent-4-enoic acid |
| related_synonym: | AZA-7; Formula=C47H71NO13; InChI=1S/C47H71NO13/c1-25-16-36-41-38(23-45(59-41)29(5)15-26(2)24-48-45)57-44(21-25,56-36)22-28(4)40-27(3)17-31(7)47(53,60-40)42(52)37-20-35-34(54-37)18-30(6)46(58-35)14-13-43(61-46)12-8-9-33(55-43)11-10-32(49)19-39(50)51/h8-11,25-27,29-38,40-42,48-49,52-53H,4,12-24H2,1-3,5-7H3,(H,50,51)/b11-10+/t25-,26+,27-,29-,30+,31+,32?,33-,34+,35+,36?,37-,38+,40-,41+,42+,43-,44-,45-,46+,47+/m0/s1; InChIKey=SXEBRIPODMGYJR-NTDZBKRRSA-N; SMILES=OC(CC(/C=C/[C@@]1(C=CC[C@]2(O1)O[C@]3(CC2)[C@@H](C[C@@]4([C@](O3)(C[C@](O4)([C@H]([C@@]5(O[C@@]([C@H](C[C@H]5C)C)(C(=C)C[C@@]67C[C@H](C[C@@H](O6)[C@@]8([C@](O7)(C[C@]9(O8)[C@H](C[C@H](CN9)C)C)[H])[H])C)[H])O)O)[H])[H])[H])C)[H])O)=O |
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