Concept information
Preferred term
5 آلفا پرگنان 3 بتا، 20 آلفا دیول دی سولفات
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C21H36O8S2
inchi
- InChI=1S/C21H36O8S2/c1-13(28-30(22,23)24)17-6-7-18-16-5-4-14-12-15(29-31(25,26)27)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19H,4-12H2,1-3H3,(H,22,23,24)(H,25,26,27)/t13-,14-,15-,16-,17+,18-,19-,20-,21+/m0/s1
inchikey
- LSQGWMYMIHQKSA-ZVPCKFNKSA-N
is_conjugate_acid_of
mass
- 480.639
monoisotopicmass
- 480.18516
smiles
- C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC[C@]2(C[C@H](C1)OS(O)(=O)=O)[H])[H])(CC[C@]4([H])[C@@H](OS(O)(=O)=O)C)[H])C)[H])C
subset
- 3_STAR
synonym EXACT
- (20S)-5alpha-pregnane-3beta,20-diyl bis(hydrogen sulfate)
synonym RELATED
- (3beta,5alpha,20S)-pregnane-3,20-diyl bis(hydrogen sulfate)
- Pregnane-3,20-diol 3,20-disulfate
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:133119
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