| Name |
[2'E,7'R(S)]-2',3'-didehydro-7'-deoxo-2'-deoxy-4',16-dihydroxy-7'-(1-hydroxyethyl)verrucarin A
Baccharinoid B 16 |
| Formula |
C29H38O10 |
| Mw |
546.24649744 |
| CAS RN |
105563-59-5 |
| C_ID |
C00012592
, 
|
| InChIKey |
TZNJVIFEPSOQCV-MVSKTLFJNA-N |
| InChICode |
InChI=1S/C29H38O10/c1-17-10-26(34)36-15-28-9-8-19(13-30)11-23(28)38-24-12-22(27(28,3)29(24)16-37-29)39-25(33)7-5-4-6-21(18(2)31)35-14-20(17)32/h4-7,10-11,18,20-24,30-32H,8-9,12-16H2,1-3H3/b6-4+,7-5+,17-10+/t18-,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(/[C@@H](CO[C@H]1[C@@H](O)C)O)\C)[C@@H](O[C@H]([C@@]13CO1)C2)C=C(CC4)CO)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Baccharis megapotamica | Ref. |
|
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