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

Details

Stereochemistry ABSOLUTE
Molecular Formula C29H31NO6S.C4H11NO3
Molecular Weight 642.76
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MK-8666 TROMETHAMINE

SMILES

NC(CO)(CO)CO.CC1=CC(OCCCS(C)(=O)=O)=CC(C)=C1C2=CC(COC3=CC4=C(C=N3)[C@H]5[C@@H](C4)[C@@H]5C(O)=O)=CC=C2

InChI

InChIKey=IMBNJMBRVNORTO-SQMFDTLJSA-N
InChI=1S/C29H31NO6S.C4H11NO3/c1-17-10-22(35-8-5-9-37(3,33)34)11-18(2)26(17)20-7-4-6-19(12-20)16-36-25-14-21-13-23-27(24(21)15-30-25)28(23)29(31)32;5-4(1-6,2-7)3-8/h4,6-7,10-12,14-15,23,27-28H,5,8-9,13,16H2,1-3H3,(H,31,32);6-8H,1-3,5H2/t23-,27-,28+;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
MK-8666 TRIS SALT
Preferred Name English
MK-8666 TROMETHAMINE
Common Name English
Code System Code Type Description
CAS
2056254-98-7
Created by admin on Mon Mar 31 23:45:21 GMT 2025 , Edited by admin on Mon Mar 31 23:45:21 GMT 2025
PRIMARY
FDA UNII
62602AEC6M
Created by admin on Mon Mar 31 23:45:21 GMT 2025 , Edited by admin on Mon Mar 31 23:45:21 GMT 2025
PRIMARY
PUBCHEM
131633978
Created by admin on Mon Mar 31 23:45:21 GMT 2025 , Edited by admin on Mon Mar 31 23:45:21 GMT 2025
PRIMARY