| Name |
Citrusin VIII |
| Formula |
C42H63N9O8 |
| Mw |
821.47996005 |
| CAS RN |
460730-19-2 |
| C_ID |
C00054940
|
| InChIKey |
KXHNUNAXSHSVTI-KHOHLVCHSA-N |
| InChICode |
InChI=1S/C42H63N9O8/c1-9-24(6)35-41(58)46-26(8)37(54)45-25(7)36(53)44-21-34(52)47-32(18-23(4)5)42(59)51-16-12-15-33(51)40(57)49-31(19-27-20-43-29-14-11-10-13-28(27)29)38(55)48-30(17-22(2)3)39(56)50-35/h10-11,13-14,20,22-26,30-33,35,43H,9,12,15-19,21H2,1-8H3,(H,44,53)(H,45,54)(H,46,58)(H,47,52)(H,48,55)(H,49,57)(H,50,56)/t24-,25-,26-,30-,31-,32-,33-,35-/m0/s1 |
| SMILES |
O=C(N1[C@](CCC1)([H])C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(N[C@@H](CC(C)C)C(N[C@@]([C@@H](C)CC)(C(N[C@H]4C)=O)[H])=O)=O)=O)[C@@H](NC(CNC([C@@H](NC4=O)C)=O)=O)CC(C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rutaceae | Citrus medica var. sarcodactylis  | Ref. |
|
|
zoom in
| Organism | Citrus medica var. sarcodactylis |
|---|
| Reference | Matsumoto, T. et al., Chem. Pharm. Bull., 2002, 50, 857-860 (isol, pmr, cmr) |
|---|
|
