Concept information
Preferred term
3،7،12 trioxo 5beta cholan 24 oate
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- -1
formula
- C24H33O5
inchi
- InChI=1S/C24H34O5/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/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/p-1/t13-,14+,16-,17+,18+,22+,23+,24-/m1/s1
inchikey
- OHXPGWPVLFPUSM-KLRNGDHRSA-M
is_conjugate_base_of
mass
- 401.517
monoisotopicmass
- 401.23335
smiles
- C1[C@@]2([C@]3(CC([C@]4([C@]([C@@]3(C(C[C@@]2(CC(C1)=O)[H])=O)[H])(CC[C@]4([H])[C@@H](CCC([O-])=O)C)[H])C)=O)[H])C
subset
- 3_STAR
synonym EXACT
- 3,7,12-trioxo-5beta-cholan-24-oate
synonym RELATED
- (5beta)-3,7,12-trioxocholan-24-oate
- dehydrocholate
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:137881
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