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3alpha,7beta,22chi-Trihydroxy-5beta-cholan-24-oic Acid

PropertiesImageOccurences in reactions
MNX_IDMNXM28589Image of MNXM28589
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC24H40O5
charge0
mass408.28757
referencelipidmapsM:LMST04010249
InChIKeyIPSHXEXQGICLQN-UPFZGEOISA-N
InChIInChI=1S/C24H40O5/c1-13(19(26)12-21(28)29)16-4-5-17-22-18(7-9-24(16,17)3)23(2)8-6-15(25)10-14(23)11-20(22)27/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16+,17-,18-,19?,20-,22-,23-,24+/m0/s1
SMILESC[C@H](C(O)CC(=O)O)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C
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IdentifierDescription
lipidmaps:LMST04010249
lipidmapsM:LMST04010249
3alpha,7beta,22chi-Trihydroxy-5beta-cholan-24-oic Acid
O5
ST 24:1