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

Details

Stereochemistry EPIMERIC
Molecular Formula C29H41N5O7S
Molecular Weight 603.73
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALTERNATIVE DEFINITION for [FK-33824]

SMILES

C[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N[C@H](CO)CC[S+](C)[O-]

InChI

InChIKey=HYZHONGSQNXMPH-IQNHEXCWSA-N
InChI=1S/C29H41N5O7S/c1-19(32-28(39)24(30)15-21-9-11-23(36)12-10-21)27(38)31-17-26(37)34(2)25(16-20-7-5-4-6-8-20)29(40)33-22(18-35)13-14-42(3)41/h4-12,19,22,24-25,35-36H,13-18,30H2,1-3H3,(H,31,38)(H,32,39)(H,33,40)/t19-,22+,24+,25+,42?/m1/s1

HIDE SMILES / InChI

Molecular Formula C29H41N5O7S
Molecular Weight 603.73
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 06:17:45 GMT 2025
Edited
by admin
on Wed Apr 02 06:17:45 GMT 2025
Record UNII
7964UKR2QN
Record Status alternative
Record Version
  • Download
Related Record Type Details
Primary Definition