input word = C00014749

Metabolite InformationStructural formula
Name Calyflorenone C
(2S,4R,6S,6aR,8R,10S,13bR)-2,3,4,6,6a,9,10,13b-Octahydro-4,8-dihydroxy-6,6a,12,13,13b-pentamethoxy-2,10-diphenyl-5H,8H-furo[2,3-f:5,4-h']bis[1]benzopyran-5-one
Formula C35H36O11
Mw 632.22576199
CAS RN 702644-92-6
C_ID C00014749 ,
InChIKey YBOJMAVDKNXHBU-GBJHZVNVNA-N
InChICode InChI=1S/C35H36O11/c1-39-30-26-28(25-21(37)17-22(18-12-8-6-9-13-18)44-29(25)31(30)40-2)46-35(43-5)33(41-3)27(38)24-20(36)16-23(19-14-10-7-11-15-19)45-32(24)34(26,35)42-4/h6-15,20-23,33,36-37H,16-17H2,1-5H3/t20-,21-,22-,23+,33+,34-,35-/m1/s1
SMILES [C@H]1(C[C@H](OC2=C1C(=O)[C@@H]([C@@]1([C@]2(c2c(O1)c1c(c(c2OC)OC)O[C@H](C[C@H]1O)c1ccccc1)OC)OC)OC)c1ccccc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCombretaceaeCalycopteris floribunda Ref.
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OrganismCalycopteris floribunda
ReferenceMayer,Phytochem.,65,(2004),593