input word = C00051948

Metabolite InformationStructural formula
Name 22-Hydroxycholesterol
22(R)-Hydroxycholesterol
Formula C27H46O2
Mw 402.34978071
CAS RN 17954-98-2
C_ID C00051948
InChIKey
InChICode InChI=1S/C27H46O2/c1-17(2)6-11-25(29)18(3)22-9-10-23-21-8-7-19-16-20(28)12-14-26(19,4)24(21)13-15-27(22,23)5/h7,17-18,20-25,28-29H,6,8-16H2,1-5H3/t18-,20-,21?,22?,23?,24?,25+,26-,27+/m0/s1
SMILES CC(C)CC[C@@H](O)[C@@H](C)C1CCC2C3CC=C4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum lycopersicum Ref.
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