CHEBI ONTOLOGY - ANNOTATIONS
The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/ . The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/ ). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term: allocholic acid
Accession: CHEBI:81308
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Definition: An allo-bile acid that is 5alpha-cholan-24-oic acid bearing three alpha-hydroxy substituents at position 3, 7 and 12.
Synonyms: exact_synonym: 3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-oic acid
related_synonym: (3alpha,5alpha,7alpha,12alpha)-3,7,12-trihydroxycholan-24-oic acid; 3alpha,7alpha,12alpha-Trihydroxy-5alpha-cholanoic acid; 5alpha-cholic acid; Formula=C24H40O5; InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1; InChIKey=BHQCQFFYRZLCQQ-PGHAKIONSA-N; SMILES=C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3([C@@H](C[C@]2(C[C@@H](C1)O)[H])O)[H])(CC[C@]4([H])[C@@H](CCC(O)=O)C)[H])C)O)[H])C
xref: CAS:2464-18-8; HMDB:HMDB0000505; KEGG:C17737; LIPID_MAPS_instance:LMST04010092
xref_mesh: MESH:C002001
xref: MetaCyc:CPD-16581; PMID:11041240; PMID:12460600; PMID:1255017; PMID:12810826; PMID:14012853; PMID:14285492; PMID:14689221; PMID:15666352; PMID:15672658; PMID:16132221; PMID:19464381; PMID:23646473; PMID:24940599; PMID:28538412; PMID:4644219; PMID:4673765; PMID:5073332; PMID:5541504; PMID:5542000; PMID:5634890; PMID:5797529; PMID:5965294; Reaxys:3222495
cyclic_relationship: is_conjugate_acid_of CHEBI:137661
G
Abcb11
ATP binding cassette subfamily B member 11
multiple interactions
ISO
allocholic acid inhibits the reaction [1-Naphthylisothiocyanate results in increased expression of ABCB11 mRNA]
CTD
PMID:37968239
NCBI chr 3:74,424,620...74,520,646
G
Abcb4
ATP binding cassette subfamily B member 4
multiple interactions
ISO
allocholic acid affects the reaction [1-Naphthylisothiocyanate results in increased expression of ABCB4 mRNA]
CTD
PMID:37968239
NCBI chr 4:26,106,895...26,164,440
G
Abcc4
ATP binding cassette subfamily C member 4
multiple interactions
ISO
allocholic acid promotes the reaction [1-Naphthylisothiocyanate results in increased expression of ABCC4 mRNA]
CTD
PMID:37968239
NCBI chr15:101,948,387...102,182,912
G
Cyp2b3
cytochrome P450, family 2, subfamily b, polypeptide 3
multiple interactions
ISO
allocholic acid inhibits the reaction [1-Naphthylisothiocyanate results in increased expression of CYP2B10 mRNA]
CTD
PMID:37968239
NCBI chr 1:90,780,468...90,859,852
G
Cyp8b1
cytochrome P450 family 8 subfamily B member 1
multiple interactions
ISO
[allocholic acid co-treated with 1-Naphthylisothiocyanate] results in decreased expression of CYP8B1 protein; allocholic acid promotes the reaction [1-Naphthylisothiocyanate results in decreased expression of CYP8B1 mRNA]
CTD
PMID:37968239
NCBI chr 8:130,455,622...130,457,592
G
Nr1i2
nuclear receptor subfamily 1, group I, member 2
multiple interactions
ISO
allocholic acid inhibits the reaction [1-Naphthylisothiocyanate results in increased expression of NR1I2 mRNA]
CTD
PMID:37968239
NCBI chr11:75,965,717...76,006,733
G
Slc10a2
solute carrier family 10 member 2
multiple interactions
ISO
allocholic acid inhibits the reaction [1-Naphthylisothiocyanate results in increased expression of SLC10A2 mRNA]
CTD
PMID:37968239
NCBI chr16:91,088,089...91,111,025
G
Slc51a
solute carrier family 51 member A
multiple interactions
ISO
allocholic acid inhibits the reaction [1-Naphthylisothiocyanate results in increased expression of SLC51A mRNA]
CTD
PMID:37968239
NCBI chr11:68,299,086...68,313,485
G
Slc51b
SLC51 subunit beta
multiple interactions
ISO
allocholic acid inhibits the reaction [1-Naphthylisothiocyanate results in increased expression of SLC51B mRNA]
CTD
PMID:37968239
NCBI chr 8:65,931,891...65,939,953
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