Preferred Name |
Dihydrotachysterol |
|
Synonyms |
(3S,5E,7E,10S,22E)-9,10-secoergosta-5,7,22-trien-3-ol Dihydrotachysterol dihydrotachysterol dihydrotachysterolum dihidrotaquisterol Anti-tetany substance 10 AT 10 |
|
Definitions |
A hydroxy seco-steroid that is 9,10-secoergosta-5,7,22-triene substituted by a hydroxy group at position 3. A synthetic analogue of vitamin D that acts a bone density conservation agent. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_4591 |
|
charge |
0 |
|
database_cross_reference |
KEGG:C06957 Drug_Central:2841 PMID:24766747 PMID:25075826 LIPID_MAPS_instance:LMST03010056 DrugBank:DB01070 Reaxys:2062504 Wikipedia:Dihydrotachysterol CAS:67-96-9 KEGG:D00299 |
|
formula |
C28H46O |
|
has role | ||
has_exact_synonym |
(3S,5E,7E,10S,22E)-9,10-secoergosta-5,7,22-trien-3-ol Dihydrotachysterol |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
dihydrotachysterol dihydrotachysterolum dihidrotaquisterol Anti-tetany substance 10 AT 10 |
|
has_RxCUI |
3429 |
|
id |
CHEBI:4591 |
|
in_subset | ||
inchi |
InChI=1S/C28H46O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-22,25-27,29H,7-8,11,14-18H2,1-6H3/b10-9+,23-12+,24-13+/t20-,21-,22+,25-,26+,27-,28+/m0/s1 |
|
inchikey |
ILYCWAKSDCYMBB-OPCMSESCSA-N |
|
label |
dihydrotachysterol Dihydrotachysterol |
|
mass |
398.66424 |
|
monoisotopicmass |
398.35487 |
|
notation |
CHEBI:4591 |
|
prefixIRI |
CHEBI:4591 |
|
prefLabel |
Dihydrotachysterol |
|
smiles |
[H][C@@]1(CC[C@]2([H])[C@]1(C)CCC\C2=C/C=C1\C[C@@H](O)CC[C@@H]1C)[C@H](C)\C=C\[C@H](C)C(C)C |
|
textual definition |
A hydroxy seco-steroid that is 9,10-secoergosta-5,7,22-triene substituted by a hydroxy group at position 3. A synthetic analogue of vitamin D that acts a bone density conservation agent. |
|
subClassOf |
http://purl.obolibrary.org/obo/CHEBI_36819 |