input word = C00008043

Metabolite InformationStructural formula
Name Sulfurein
Formula C21H20O10
Mw 432.10564686
CAS RN 531-63-5
C_ID C00008043 ,
InChIKey MEHCTOVFPFJFEW-OHPGNTIMNA-N
InChICode InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-10-2-3-11-14(7-10)30-15(17(11)25)6-9-1-4-12(23)13(24)5-9/h1-7,16,18-24,26-28H,8H2/b15-6-/t16-,18-,19+,20-,21-/m1/s1
SMILES c12c(cc(cc1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O/C(=C\c1ccc(c(c1)O)O)/C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnacardiaceaeCotinus coggygria Ref.
PlantaeAsteraceaeBaeria chrysostoma Ref.
PlantaeAsteraceaeBidens spp. Ref.
PlantaeAsteraceaeCoreopsis spp. Ref.
PlantaeAsteraceaeDahlia variabilis Ref.
PlantaeAsteraceaeSimsia spp. Ref.
PlantaeAsteraceaeTithonia koelzii Ref.
PlantaeAsteraceaeViguiera multiflora Ref.
PlantaeFabaceaeButea monosperma Ref.
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