input word = C00042081

Metabolite InformationStructural formula
Name 24xi-Methylcholesterol
Formula C28H48O
Mw 400.37051615
CAS RN 23929-42-2
C_ID C00042081 ,
InChIKey SGNBVLSWZMBQTH-VLGBNQDNNA-N
InChICode InChI=1S/C28H48O/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/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1
SMILES C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]1([C@H]3CC[C@@H]1[C@H](C)CC[C@@H](C(C)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeHordeum vulgare L.cv Mammut Ref.
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