| Name |
Roritoxin A
7',8'-Didehydrovertisporin |
| Formula |
C29H34O10 |
| Mw |
542.21519731 |
| CAS RN |
102852-48-2 |
| C_ID |
C00012678
, 
|
| InChIKey |
OKEHNIGMVFQYPZ-JBQVEOKHNA-N |
| InChICode |
InChI=1S/C29H34O10/c1-16-6-9-27-14-34-22(31)12-17-7-10-35-28(23(32)25(33)39-24(17)28)8-4-3-5-21(30)38-18-13-20(37-19(27)11-16)29(15-36-29)26(18,27)2/h3-5,8,11-12,16,18,20,23-25,32-33H,6-7,9-10,13-15H2,1-2H3/b5-3+,8-4-,17-12-/t16-,18+,20-,23+,24+,25-,26-,27-,28+,29+/m0/s1 |
| SMILES |
[C@]123C(=C[C@H](CC1)C)O[C@@H]1[C@]4([C@]2([C@@H](C1)OC(=O)/C=C/C=C\[C@]12OCC/C(=C/C(=O)OC3)/[C@H]1O[C@@H]([C@H]2O)O)C)OC4 |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Incertae sedis | Myrothecium roridum | Ref. |
|
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