| Name |
Cathedulin 8
Cathedulin E 8
Catheduline E 8
(3alpha,4alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha)-[6,7-bis(Acetyloxy)-5-(benzoyloxy)octahydro-4-hydroxy-2,2,9-trimethyl-5aH-3,9a-methano-1-benzoxepin-5a-yl]methyl ester 3-pyridinecarboxylic acid |
| Formula |
C32H37NO10 |
| Mw |
595.24174641 |
| CAS RN |
61166-34-5 |
| C_ID |
C00013167
, 
|
| InChIKey |
KJTLLJIFKAOOJH-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C32H37NO10/c1-18-14-24(40-19(2)34)26(41-20(3)35)31(17-39-28(37)22-12-9-13-33-16-22)27(42-29(38)21-10-7-6-8-11-21)25(36)23-15-32(18,31)43-30(23,4)5/h6-13,16,18,23-27,36H,14-15,17H2,1-5H3/t18-,23-,24-,25+,26-,27-,31-,32-/m0/s1 |
| SMILES |
CC(=O)OC1CC(C)C23CC(C(O)C(OC(=O)c4ccccc4)C2(COC(=O)c2cccnc2)C1OC(C)=O)C(C)(C)O3 |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Asp IPP L-His |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Catha edulis  | Ref. |
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