input word = C00039130

Metabolite InformationStructural formula
Name epi-Fibrauretinoside A
(+)-epi-Fibrauretinoside A
Formula C26H34O12
Mw 538.20502655
CAS RN 960506-34-7
C_ID C00039130 ,
InChIKey KTLOXVIRNBVBRP-LGGRTNRZNA-N
InChICode InChI=1S/C26H34O12/c1-23-8-13(12-5-7-34-10-12)37-22(32)26(23,33)19(31)20-24(2)15(23)4-3-6-25(24,11-35-20)38-21-18(30)17(29)16(28)14(9-27)36-21/h3,5-7,10,13-21,27-31,33H,4,8-9,11H2,1-2H3/t13-,14+,15-,16+,17-,18+,19-,20+,21-,23-,24-,25+,26-/m0/s1
SMILES C[C@]12[C@@H]3OC[C@]1(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C=CC[C@H]2[C@]1(C)C[C@@H](c2ccoc2)OC(=O)[C@@]1(O)[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMenispermaceaeFibraurea tinctoria Ref.
zoom in