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3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-27-al

PropertiesImageOccurences in reactions
MNX_IDMNXM867Image of MNXM867
#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 8
formulaC27H46O4
charge0
mass434.65174
referencebiggM:CE4872
InChIKeyUSFJGINJGUIFSY-VQKUADTHSA-N
InChIInChI=1S/C27H46O4/c1-16(15-28)6-5-7-17(2)20-8-9-21-25-22(14-24(31)27(20,21)4)26(3)11-10-19(29)12-18(26)13-23(25)30/h15-25,29-31H,5-14H2,1-4H3/t16?,17-,18?,19+,20-,21?,22?,23+,24-,25?,26?,27-/m1/s1
SMILESCC(CCC[C@@H](C)[C@H]1CCC2C3[C@@H](O)CC4C[C@@H](O)CCC4(C)C3C[C@@H](O)[C@]12C)C=O
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
bigg.metabolite:CE4872
biggM:CE4872
3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-27-al
biggM:M_CE4872 secondary/obsolete/fantasy identifier