| Name |
Pescaprein XVI
(-)-Pescaprein XVI |
| Formula |
C72H116O25 |
| Mw |
1380.78056926 |
| CAS RN |
1100362-85-3 |
| C_ID |
C00039967
, 
|
| InChIKey |
NDKPFZJXDUTDOW-DADJYUMENA-N |
| InChICode |
InChI=1S/C72H116O25/c1-10-13-15-16-17-18-21-24-32-38-50(74)92-66-65(97-68-56(80)54(78)52(76)42(5)84-68)61(94-69-57(81)62(59(44(7)86-69)93-67(83)41(4)12-3)91-51(75)40-39-47-33-28-26-29-34-47)46(9)88-72(66)95-60-45(8)87-70-58(82)63(60)90-49(73)37-31-25-22-19-20-23-30-36-48(35-27-14-11-2)89-71-64(96-70)55(79)53(77)43(6)85-71/h26,28-29,33-34,39-46,48,52-66,68-72,76-82H,10-25,27,30-32,35-38H2,1-9H3/b40-39+/t41-,42-,43+,44-,45-,46-,48-,52-,53-,54+,55-,56+,57+,58-,59-,60-,61-,62-,63-,64+,65+,66+,68+,69-,70-,71-,72-/m0/s1 |
| SMILES |
[C@@H]12[C@H](O[C@H](CCCCCCCCCC(=O)O[C@H]3[C@@H]([C@H](O1)O[C@H]([C@@H]3O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1OC(=O)CCCCCCCCCCC)O[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)OC(=O)[C@H](CC)C)OC(=O)/C=C/c1ccccc1)O)C)C)O)CCCCC)O[C@@H]([C@@H]([C@@H]2O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Convolvulaceae | Ipomoea pes-caprae  | Ref. |
|
|
zoom in
| Organism | Ipomoea pes-caprae |
|---|
| Reference | Tao,J.Nat.Prod.,71,(2008),1998 |
|---|
|
