Concept information
Preferred term
3alpha,7alpha,12alpha,26-tetrahydroxy-5alpha-cholestan-27-oic acid
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C27H46O6
inchi
- InChI=1S/C27H46O6/c1-15(5-4-6-16(14-28)25(32)33)19-7-8-20-24-21(13-23(31)27(19,20)3)26(2)10-9-18(29)11-17(26)12-22(24)30/h15-24,28-31H,4-14H2,1-3H3,(H,32,33)/t15-,16?,17-,18-,19-,20+,21+,22-,23+,24+,26+,27-/m1/s1
inchikey
- WJAIFDIPOPXOPB-AMPWAIRWSA-N
mass
- 466.659
monoisotopicmass
- 466.32944
smiles
- O[C@@H]1[C@]2([C@]([C@]3([C@@]([C@@]4([C@@](C[C@H]3O)(C[C@H](O)CC4)[H])C)(C1)[H])[H])(CC[C@@]2([C@@H](CCCC(CO)C(O)=O)C)[H])[H])C
subset
- 2_STAR
synonym EXACT
- (6R)-2-(hydroxymethyl)-6-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]heptanoic acid
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:181782
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