Concept information
Preferred term
3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
Narrower concepts
alt_id
- CHEBI:11897
- CHEBI:11898
- CHEBI:1698
- CHEBI:20219
- CHEBI:20220
charge
- 0
formula
- C27H46O5
has_parent_hydride
has_role
inchi
- InChI=1S/C27H46O5/c1-15(6-5-7-16(2)25(31)32)19-8-9-20-24-21(14-23(30)27(19,20)4)26(3)11-10-18(28)12-17(26)13-22(24)29/h15-24,28-30H,5-14H2,1-4H3,(H,31,32)/t15-,16?,17+,18-,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1
inchikey
- CNWPIIOQKZNXBB-VCVMUKOKSA-N
is_conjugate_acid_of
mass
- 450.65110
monoisotopicmass
- 450.33452
smiles
- C[C@H](CCCC(C)C(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]3C[C@H](O)[C@]12C
subset
- 3_STAR
synonym EXACT
- 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid
synonym RELATED
- 3,7,12-trihydroxycholestan-26-oic acid
- (3alpha,5beta,7alpha,12alpha)-3,7,12-trihydroxycholestan-26-oic acid
- coprocholic acid
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:18402
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