input word = C00031775

Metabolite InformationStructural formula
Name erythro-Carolignan E
Formula C40H42O13
Mw 730.26254143
CAS RN 344944-08-7
C_ID C00031775 ,
InChIKey CXFBVHGWTGTGBR-XEYDVGEWNA-N
InChICode InChI=1S/C40H42O13/c1-47-33-20-26(7-13-29(33)41)10-17-38(44)51-19-5-6-25-9-16-32(36(22-25)50-4)53-37(40(46)28-12-15-31(43)35(23-28)49-3)24-52-39(45)18-11-27-8-14-30(42)34(21-27)48-2/h7-18,20-23,37,40-43,46H,5-6,19,24H2,1-4H3/b17-10+,18-11+/t37-,40-/m0/s1
SMILES c1c(cc(c(c1)O)OC)/C=C/C(=O)OC[C@H](Oc1ccc(cc1OC)CCCOC(=O)/C=C/c1cc(c(cc1)O)OC)[C@@H](O)c1cc(c(cc1)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeHibiscus taiwanensis Ref.
zoom in