| Name |
Acetylpringleine
[3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9beta,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,10-diacetate 5,7-dibenzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,9,10-pentol |
| Formula |
C35H40O12 |
| Mw |
652.25197674 |
| CAS RN |
111950-72-2 |
| C_ID |
C00013137
, 
|
| InChIKey |
ZZFJSWIPFJPKST-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C35H40O12/c1-20(36)42-19-34-27(46-31(40)24-15-11-8-12-16-24)17-25-28(43-21(2)37)35(34,47-32(25,4)5)33(6,41)18-26(29(34)44-22(3)38)45-30(39)23-13-9-7-10-14-23/h7-16,25-29,41H,17-19H2,1-6H3/t25-,26-,27-,28+,29-,33-,34-,35+/m0/s1 |
| SMILES |
O1[C@@]23[C@@]([C@H](C[C@H](C1(C)C)[C@H]3OC(=O)C)OC(=O)c1ccccc1)([C@H]([C@H](C[C@]2(C)O)OC(=O)c1ccccc1)OC(=O)C)COC(=O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Celastrus pringlei | Ref. |
|
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