input word = C00061147

Metabolite InformationStructural formula
Name 3beta-Hydroxy-24-methylcholesta-5,22-diene
Formula C28H46O
Mw 398.35486609
CAS RN 2638-57-5
C_ID C00061147
InChIKey OILXMJHPFNGGTO-OAFVHITRSA-N
InChICode InChI=1S/C28H46O/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/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19?,20-,22+,23+,24-,25+,26+,27+,28-/m1/s1
SMILES CC(C)C(C)C=CC(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
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