| Name |
(3R,5S,5aS,6R,7S,9S,9aS,10R)-6,7,10-Tris(acetyloxy)-5a-[(acetyloxy)methyl]-5-(benzoyloxy)octahydro-9-hydroxy-2,2,9-trimethyl-4H-3,9a-methano-1-benzoxepin-4-one |
| Formula |
C30H36O13 |
| Mw |
604.21559124 |
| CAS RN |
94529-73-4 |
| C_ID |
C00063466
|
| InChIKey |
OJGXAVOFNQDIPX-VRQAVGBSSA-N |
| InChICode |
InChI=1S/C30H36O13/c1-15(31)38-14-29-23(40-17(3)33)20(39-16(2)32)13-28(7,37)30(29)24(41-18(4)34)21(27(5,6)43-30)22(35)25(29)42-26(36)19-11-9-8-10-12-19/h8-12,20-21,23-25,37H,13-14H2,1-7H3/t20-,21+,23-,24+,25+,28-,29-,30-/m0/s1 |
| SMILES |
CC(=O)OCC12C(OC(=O)c3ccccc3)C(=O)C3C(OC(C)=O)C1(OC3(C)C)C(C)(O)CC(OC(C)=O)C2OC(C)=O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Tripterygium wilfordii  | Ref. |
|
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