Name: | BISTHEONELLIDE A |
CAS: | 105304-96-9 |
Synonyms: | MISAKINOLID A ; MISAKINOLIDE A ; BISTHEONELLIDE A |
MDL.: | MFCD03427370 |
H bond acceptor: | 20 |
H bond donor: | 8 |
Smile: | C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2[C@H]([C@@H](C[C@@H]([C@@H](C(C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C(=O)O[C@@H]([C@H]([C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C(=O)O2)\C)O)OC)C)O)O)C)[C@@H](C)[C@H]([C@@H](C)CC[C@H]5C[C@@H](C[C@@H](O5)C)OC)O)\C)O)OC)C)O)O)C)O)OC |
InChi: | InChI=1S/C74H128O20/c1-41(25-29-59-35-61(85-13)31-45(5)89-59)69(81)51(11)71-49(9)65(79)39-63(77)47(7)67(87-15)37-57-21-18-20-56(92-57)34-54(76)28-24-44(4)74(84)94-72(52(12)70(82)42(2)26-30-60-36-62(86-14)32-46(6)90-60)50(10)66(80)40-64(78)48(8)68(88-16)38-58-22-17-19-55(91-58)33-53(75)27-23-43(3)73(83)93-71/h17-20,23-24,41-42,45-72,75-82H,21-22,25-40H2,1-16H3/b43-23+,44-24+/t41-,42-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61+,62+,63-,64-,65+,66+,67-,68?,69-,70-,71-,72-/m0/s1 |
InChiKey: | InChIKey=CNXAVQHYRALFDY-FZBVXCEASA-N |
BISTHEONELLIDE A
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