| Name |
Swinholide C |
| Formula |
C77H130O20 |
| Mw |
1374.91554659 |
| CAS RN |
132923-51-4 |
| C_ID |
C00040421
, 
|
| InChIKey |
JHJBENWDNPVGHA-KFHUQJTANA-N |
| InChICode |
InChI=1S/C77H130O20/c1-44-22-28-56(78)36-59-19-17-21-62(95-59)41-71(91-15)51(8)67(82)43-69(84)53(10)77(55(12)75(88)47(4)27-31-64-39-65(89-13)35-49(6)93-64)97-73(86)33-25-45(2)23-29-57(79)37-60-18-16-20-61(94-60)40-70(90-14)50(7)66(81)42-68(83)52(9)76(96-72(85)32-24-44)54(11)74(87)46(3)26-30-63-38-58(80)34-48(5)92-63/h16,18-19,22-25,32-33,46-58,60-71,74-84,87-88H,17,20-21,26-31,34-43H2,1-15H3/b32-24-,33-25-,44-22+,45-23+/t46-,47-,48+,49+,50+,51-,52+,53+,54-,55-,56-,57+,58-,60+,61-,62-,63-,64-,65+,66+,67-,68+,69+,70-,71+,74-,75+,76-,77-/m1/s1 |
| SMILES |
C1(=O)/C=C\C(=C\C[C@H](CC2=CCC[C@@H](O2)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]2O[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)O)C)O)O)C)OC)CC=C2)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)OC)O)\C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Theonella swinhoei | Ref. |
|
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