| Name |
[7'R(S),9R,10S]-7'-Deoxo-2'-deoxy-9,10-epoxy-9,10-dihydro-4'-hydroxy-7'-(1-hydroxyethyl)verrucarin A
Baccharinoid B 20 |
| Formula |
C29H40O10 |
| Mw |
548.2621475 |
| CAS RN |
105563-55-1 |
| C_ID |
C00012588
, 
|
| InChIKey |
BTEOYJDZVAVHJF-KQQUZDAGNA-N |
| InChICode |
InChI=1S/C29H40O10/c1-16-11-23(33)35-14-28-10-9-26(3)24(39-26)25(28)38-21-12-20(27(28,4)29(21)15-36-29)37-22(32)8-6-5-7-19(17(2)30)34-13-18(16)31/h5-8,16-21,24-25,30-31H,9-15H2,1-4H3/b7-5+,8-6+/t16-,17+,18+,19-,20-,21-,24-,25-,26+,27-,28+,29+/m1/s1 |
| SMILES |
C\1=C/C=C/C(=O)O[C@H]2[C@@]3([C@@]4(COC(=O)C[C@H]([C@H](CO[C@H]1[C@@H](O)C)O)C)[C@H](O[C@@H]([C@]13CO1)C2)[C@@H]1[C@@](CC4)(C)O1)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Baccharis megapotamica | Ref. |
|
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