input word = C00061625

Metabolite InformationStructural formula
Name Ergosta-7,22,24(28)-trien-3beta-ol
Formula C28H44O
Mw 396.33921603
CAS RN 36680-39-4
C_ID C00061625
InChIKey JSCPZXGREHLRCU-JLNLVNAISA-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/h7-8,10,18,20-22,24-26,29H,3,9,11-17H2,1-2,4-6H3/b8-7+/t20-,21+,22+,24-,25+,26+,27+,28-/m1/s1
SMILES C=C(C=CC(C)C1CCC2C3=CCC4CC(O)CCC4(C)C3CCC21C)C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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