| Name |
Swinholide D |
| Formula |
C77H130O20 |
| Mw |
1374.91554659 |
| CAS RN |
139178-92-0 |
| C_ID |
C00040422
, 
|
| InChIKey |
DLBZSGSOXDFVJT-KFHUQJTANA-N |
| InChICode |
InChI=1S/C77H130O20/c1-44-22-28-56(78)36-58-18-16-20-60(94-58)40-66(80)50(7)67(81)42-69(83)52(9)76(54(11)74(87)46(3)26-30-62-38-64(89-13)34-48(5)92-62)96-72(85)32-24-45(2)23-29-57(79)37-59-19-17-21-61(95-59)41-71(91-15)51(8)68(82)43-70(84)53(10)77(97-73(86)33-25-44)55(12)75(88)47(4)27-31-63-39-65(90-14)35-49(6)93-63/h16-19,22-25,32-33,46-71,74-84,87-88H,20-21,26-31,34-43H2,1-15H3/b32-24-,33-25-,44-22+,45-23+/t46-,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-,74-,75-,76+,77+/m0/s1 |
| SMILES |
C1(=O)/C=C\C(=C\C[C@H](C[C@H]2O[C@H](C[C@@H]([C@@H]([C@@H](C[C@H]([C@@H]([C@@H](OC(=O)/C=C\C(=C\C[C@H](C[C@@H]3O[C@@H](C[C@@H]([C@@H]([C@H](C[C@H]([C@H]([C@@H](O1)[C@H](C)[C@@H](O)[C@H](C)CC[C@@H]1C[C@@H](C[C@H](O1)C)OC)C)O)O)C)OC)CC=C3)O)\C)[C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]1C[C@@H](C[C@H](O1)C)OC)C)O)O)C)O)CC=C2)O)\C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Theonella swinhoei | Ref. |
|
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