| Name |
[4'R,7'R(R),8R]-7'-Deoxo-2'-deoxy-4',8-dihydroxy-7'-(1-hydroxyethyl)verrucarin A
Baccharanoid B1
Baccharin B1
Baccharinoid B 1
Baccharol |
| Formula |
C29H40O10 |
| Mw |
548.2621475 |
| CAS RN |
71695-69-7 |
| C_ID |
C00012582
, 
|
| InChIKey |
PYYBXMVTBWYBDY-KQQUZDAGNA-N |
| InChICode |
InChI=1S/C29H40O10/c1-16-9-23-28(12-19(16)31)14-36-26(34)10-17(2)20(32)13-35-21(18(3)30)7-5-6-8-25(33)39-22-11-24(38-23)29(15-37-29)27(22,28)4/h5-9,17-24,30-32H,10-15H2,1-4H3/b7-5+,8-6+/t17-,18+,19+,20-,21-,22-,23+,24-,27-,28+,29+/m0/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=C([C@@H](C4)O)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Baccharis megapotamica | Ref. |
|
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