input word = C00014743

Metabolite InformationStructural formula
Name Neocalycopterone
(2R,7aR,11R,13S,14aR)-2,3,12,13-Tetrahydro-13-hydroxy-6,7,7a,8,9-pentamethoxy-2,11-diphenyl-11H-furo[2,3-f:4,5-i']bis[1]benzopyran-5(7aH)-one
Formula C35H34O10
Mw 614.21519731
CAS RN 247122-60-7
C_ID C00014743 ,
InChIKey CAPJLGPKGOVWIU-YKNNFBQKNA-N
InChICode InChI=1S/C35H34O10/c1-38-30-26-28(25-22(36)18-24(20-14-10-7-11-15-20)43-29(25)32(30)40-3)45-35-21(16-17-23(44-35)19-12-8-6-9-13-19)27(37)31(39-2)33(41-4)34(26,35)42-5/h6-16,22-24,36H,17-18H2,1-5H3/t22-,23-,24-,34-,35-/m1/s1
SMILES C1(=O)C(=C([C@]2([C@@]3(C1=CC[C@@H](O3)c1ccccc1)Oc1c2c(c(c2c1[C@@H](C[C@@H](O2)c1ccccc1)O)OC)OC)OC)OC)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCombretaceaeCalycopteris floribunda Ref.
zoom in



OrganismCalycopteris floribunda
ReferenceWall,J.Med.Chem.,37,(1994),1465