input word = C00063166

Metabolite InformationStructural formula
Name (3beta,22R,23R,24S)-Ergost-5-ene-3,22,23-triol
Formula C28H48O3
Mw 432.3603454
CAS RN 85707-12-6
C_ID C00063166
InChIKey UJGZOSZMMQGHPD-GTYSVAQVSA-N
InChICode InChI=1S/C28H48O3/c1-16(2)17(3)25(30)26(31)18(4)22-9-10-23-21-8-7-19-15-20(29)11-13-27(19,5)24(21)12-14-28(22,23)6/h7,16-18,20-26,29-31H,8-15H2,1-6H3/t17-,18-,20-,21-,22+,23-,24-,25+,26+,27-,28+/m0/s1
SMILES CC(C)C(C)C(O)C(O)C(C)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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OrganismArabidopsis thaliana
Referencehttps://doi.org/10.1105/tpc.106.045443