U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H44O
Molecular Weight 384.6377
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TACHYSTEROL 3

SMILES

[H][C@@]1(CC[C@@]2([H])C(=CCC[C@]12C)\C=C\C3=C(C)CC[C@H](O)C3)[C@H](C)CCCC(C)C

InChI

InChIKey=YUGCAAVRZWBXEQ-FMCTZRJNSA-N
InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h10,12-13,19,21,24-26,28H,6-9,11,14-18H2,1-5H3/b13-12+/t21-,24+,25-,26+,27-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
TACHYSTEROL 3
Common Name English
3-CYCLOHEXEN-1-OL, 3-((1E)-2-((1R,3AR,7AR)-1-((1R)-1,5-DIMETHYLHEXYL)-2,3,3A,6,7,7A-HEXAHYDRO-7A-METHYL-1H-INDEN-4-YL)ETHENYL)-4-METHYL-, (1S)-
Systematic Name English
9,10-SECOCHOLESTA-5(10),6,8-TRIEN-3-OL, (3.BETA.,6E)-
Systematic Name English
TACHYSTEROL3
Common Name English
CHOLECALCIFEROL IMPURITY E [EP IMPURITY]
Common Name English
Code System Code Type Description
CHEBI
166835
Created by admin on Sat Dec 16 10:25:40 GMT 2023 , Edited by admin on Sat Dec 16 10:25:40 GMT 2023
PRIMARY
CAS
17592-07-3
Created by admin on Sat Dec 16 10:25:40 GMT 2023 , Edited by admin on Sat Dec 16 10:25:40 GMT 2023
PRIMARY
FDA UNII
6RR0I9PK8W
Created by admin on Sat Dec 16 10:25:40 GMT 2023 , Edited by admin on Sat Dec 16 10:25:40 GMT 2023
PRIMARY
ECHA (EC/EINECS)
241-561-3
Created by admin on Sat Dec 16 10:25:40 GMT 2023 , Edited by admin on Sat Dec 16 10:25:40 GMT 2023
PRIMARY
PUBCHEM
5283713
Created by admin on Sat Dec 16 10:25:40 GMT 2023 , Edited by admin on Sat Dec 16 10:25:40 GMT 2023
PRIMARY