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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H18N2O2
Molecular Weight 234.2942
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PSILOMETHOXIN

SMILES

COC1=C(O)C2=C(NC=C2CCN(C)C)C=C1

InChI

InChIKey=YTBHRCRBKLRGBT-UHFFFAOYSA-N
InChI=1S/C13H18N2O2/c1-15(2)7-6-9-8-14-10-4-5-11(17-3)13(16)12(9)10/h4-5,8,14,16H,6-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C13H18N2O2
Molecular Weight 234.2942
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
DZ7JH6CVB7
Record Status Validated (UNII)
Record Version