input word = C00015756

Metabolite InformationStructural formula
Name Copalliferol A
Formula C42H32O9
Mw 680.20463262
CAS RN 75514-29-3
C_ID C00015756 ,
InChIKey OAJMDVHEWRVSMZ-IRNYJKQCNA-N
InChICode InChI=1S/C42H32O9/c43-20-5-1-18(2-6-20)34-37-29(13-24(47)16-32(37)50)41-35(19-3-7-21(44)8-4-19)38-30(14-25(48)17-33(38)51)42(41)39-26-10-9-22(45)11-27(26)36-28(40(34)39)12-23(46)15-31(36)49/h1-17,34-35,39-51H/t34-,35-,39-,40-,41+,42-/m1/s1
SMILES c1(ccc(cc1)[C@H]1[C@H]2[C@H](c3c1c(cc(c3)O)O)[C@H]1[C@@H]([C@@H](c3c2cc(cc3O)O)c2ccc(cc2)O)c2c(c3c1ccc(c3)O)c(cc(c2)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDipterocarpaceaeHopea cordifolia Ref.
PlantaeDipterocarpaceaeShorea stipularis Ref.
PlantaeDipterocarpaceaeStemonoporus affinis Ref.
PlantaeDipterocarpaceaeStemonoporus elegans Ref.
PlantaeDipterocarpaceaeStemonoporus kanneliyensis Ref.
PlantaeDipterocarpaceaeStemonoporus oblongifolius Ref.
PlantaeDipterocarpaceaeVatica copallifera Ref.
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OrganismStemonoporus affinis
ReferenceSamaraweera,Phytochem.,21,(1982),2585