Concept information
Preferred term
1alpha-hydroxy-18-(4-hydroxy-4-methylpentyloxy)-23,24,25,26,27-pentanorvitamin d3 / 1alpha-hydroxy-18-(4-hydroxy-4-methylpentyloxy)-23,24,25,26,27-pentanorcholecalciferol
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C28H46O4
inchi
- InChI=1S/C28H46O4/c1-19(2)24-11-12-25-21(9-10-22-16-23(29)17-26(30)20(22)3)8-6-14-28(24,25)18-32-15-7-13-27(4,5)31/h9-10,19,23-26,29-31H,3,6-8,11-18H2,1-2,4-5H3/b21-9+,22-10-/t23-,24-,25+,26+,28+/m1/s1
inchikey
- HGAXPRRONVFXKS-NBCLANQFSA-N
mass
- 446.672
monoisotopicmass
- 446.33961
smiles
- O(C[C@@]12[C@H](CC[C@]1(/C(/CCC2)=C/C=C/3/C[C@@H](O)C[C@H](O)C3=C)[H])C(C)C)CCCC(O)(C)C
subset
- 2_STAR
synonym EXACT
- (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aS)-7a-[(4-hydroxy-4-methylpentoxy)methyl]-1-propan-2-yl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:178539
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