| Name |
(2'S,3'R,4'S,7'R,8R)-7'-Deoxo-2'-deoxy-2',3'-epoxy-4',8-dihydroxy-7'-[(1R)-1-hydroxyethyl]verrucarin A
Baccharin B4
Baccharinoid B 4
Baccharinol
Baccharinol B4 |
| Formula |
C29H38O11 |
| Mw |
562.24141206 |
| CAS RN |
63783-94-8 |
| C_ID |
C00012596
, 
|
| InChIKey |
ZGOCMMMDEQOCDU-KQQUZDAGNA-N |
| InChICode |
InChI=1S/C29H38O11/c1-15-9-21-28(11-17(15)31)13-36-25(34)24-26(3,40-24)19(32)12-35-18(16(2)30)7-5-6-8-23(33)39-20-10-22(38-21)29(14-37-29)27(20,28)4/h5-9,16-22,24,30-32H,10-14H2,1-4H3/b7-5+,8-6+/t16-,17-,18+,19+,20-,21-,22-,24-,26-,27-,28-,29+/m0/s1 |
| SMILES |
C\1=C/C=C/C(=O)O[C@@H]2[C@]3([C@@]4(COC(=O)[C@H]5[C@@]([C@@H](CO[C@H]1[C@@H](O)C)O)(C)O5)[C@@H](O[C@H]([C@@]13CO1)C2)C=C([C@H](C4)O)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Baccharis megapotamica | Ref. |
|
|
zoom in
|
