| Name |
Celahinine A |
| Formula |
C53H53NO18 |
| Mw |
991.3262639 |
| CAS RN |
172889-43-9 |
| C_ID |
C00028014
, 
|
| InChIKey |
XUNSLSCXXHEUHR-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C53H53NO18/c1-28-29(2)45(58)69-42-40(67-32(5)57)44(71-48(61)35-22-15-10-16-23-35)52(27-64-30(3)55)43(70-47(60)34-20-13-9-14-21-34)39(66-31(4)56)37-41(68-46(59)33-18-11-8-12-19-33)53(52,51(42,7)63)72-50(37,6)26-65-49(62)36-24-17-25-54-38(28)36/h8-25,28-29,37,39-44,63H,26-27H2,1-7H3/t28-,29-,37+,39+,40+,41+,42-,43-,44-,50-,51-,52+,53-/m0/s1 |
| SMILES |
CC(=O)OCC12C(OC(=O)c3ccccc3)C(OC(C)=O)C3C(OC(=O)c4ccccc4)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(C)=O)C2OC(=O)c1ccccc1)C4(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Celastrus hindsii | Ref. |
|
|
zoom in
| Organism | Celastrus hindsii |
|---|
| Reference | Kuo,J.Nat.Prod.,58,(1995),1735 |
|---|
|
