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(Q76295175)
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English
24-nor-5beta-cholane-3alpha,7alpha,12alpha,23-tetrol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
24-norcholane steroid
0 references
mass
380.29265975999994
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
chemical formula
C₂₃H₄₀O₄
0 references
canonical SMILES
CC(CCO)C1CCC2C3C(O)CC4CC(O)CCC4(C)C3CC(O)C12C
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@H](CCO)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C
0 references
found in taxon
Malus domestica
1 reference
reference URL
https://www.ebi.ac.uk/metabolights/MTBLS2384
Identifiers
InChI
InChI=1S/C23H40O4/c1-13(7-9-24)16-4-5-17-21-18(12-20(27)23(16,17)3)22(2)8-6-15(25)10-14(22)11-19(21)26/h13-21,24-27H,4-12H2,1-3H3/t13-,14+,15-,16-,17+,18+,19-,20+,21+,22+,23-/m1/s1
0 references
InChIKey
SLNNQUHVOGVMBG-ZTSBSJDLSA-N
0 references
PubChem CID
5284299
0 references
ChEBI ID
168526
0 references
UniChem compound ID
54712037
1 reference
stated in
UniChem
LIPID MAPS ID
LMST04060003
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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