input word = C00007520

Metabolite InformationStructural formula
Name (22S,24R)-22-Hydroxy-5alpha-ergostan-3-one
Formula C28H48O2
Mw 416.36543078
CAS RN 208586-82-7
C_ID C00007520 ,
InChIKey XGIZPVUTLMXXTK-FRCKABMRNA-N
InChICode InChI=1S/C28H48O2/c1-17(2)18(3)15-26(30)19(4)23-9-10-24-22-8-7-20-16-21(29)11-13-27(20,5)25(22)12-14-28(23,24)6/h17-20,22-26,30H,7-16H2,1-6H3/t18-,19+,20+,22-,23+,24+,25-,26+,27-,28+/m1/s1
SMILES C1C(=O)C[C@H]2[C@@](C1)([C@H]1[C@H](CC2)[C@H]2[C@@](CC1)([C@@H](CC2)[C@H](C)[C@H](C[C@H](C(C)C)C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
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