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6alpha-Hydroxy-3-oxochol-4-en-24-oic Acid

PropertiesImageOccurences in reactions
MNX_IDMNXM29949Image of MNXM29949
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC24H36O4
charge0
mass388.26136
referencelipidmapsM:LMST04010406
InChIKeyVNVAJHCQVWXNTN-TWYCKBTRSA-N
InChIInChI=1S/C24H36O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h12,14,16-19,21,26H,4-11,13H2,1-3H3,(H,27,28)/t14-,16+,17-,18+,19+,21+,23-,24-/m1/s1
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3C[C@H](O)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
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IdentifierDescription
lipidmaps:LMST04010406
lipidmapsM:LMST04010406
6alpha-Hydroxy-3-oxochol-4-en-24-oic Acid
O4
ST 24:3