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
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|
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) |
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Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Asteraceae | Baccharis megapotamica | Ref. |
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zoom in
Organism | Baccharis megapotamica | Reference | Jarvis,J.Org.Chem.,52,(1987),45 |
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