input word = C00007261

Metabolite InformationStructural formula
Name 5-Dehydroepisterol
24-Methylcholesta-5,7,24(28)-trienol
Ergosta-5,7,24(28)-trien-3beta-ol
Formula C28H44O
Mw 396.33921603
CAS RN 23582-83-4
C_ID C00007261 ,
InChIKey ZEPNVCGPJXYABB-MCVQFUOHNA-N
InChICode InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9-10,18,20,22,24-26,29H,3,7-8,11-17H2,1-2,4-6H3/t20-,22+,24-,25+,26+,27+,28-/m1/s1
SMILES C1[C@@H](CC2=CC=C3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3CC[C@@H]1[C@@H](CCC(=C)C(C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhaeosphaeriaceaeLeptosphaeria typhae Ref.
FungiPhycomycetaceaePhycomyces blakesleeanus Ref.
FungiSaccharomycetaceaeCandida albicans Ref.
FungiSaccharomycetaceaeCandida utilis Ref.
FungiSaccharomycetaceaeSaccharomyces carlsbergensis Ref.
FungiSaccharomycetaceaeSaccharomyces cerevisiae Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
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