Dazdotuftide trifluoroacetate

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C43H68N13O13P.C2HF3O2
Molecular Weight	1120.0764
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 7
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of Dazdotuftide trifluoroacetate

Structure Search

SMILES

OC(=O)C(F)(F)F.C[C@@H](O)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC2=CC=C(O)C(=C2)\N=N\C3=CC=C(OP([O-])(=O)OCC[N+](C)(C)C)C=C3)C(O)=O

InChI

InChIKey=FGKOZYLBDQGCJA-ZZFXKBOKSA-N

InChI=1S/C43H68N13O13P.C2HF3O2/c1-26(57)37(45)40(62)52-31(9-5-6-18-44)41(63)55-20-8-11-34(55)39(61)51-30(10-7-19-48-43(46)47)38(60)49-25-36(59)50-33(42(64)65)24-27-12-17-35(58)32(23-27)54-53-28-13-15-29(16-14-28)69-70(66,67)68-22-21-56(2,3)4;3-2(4,5)1(6)7/h12-17,23,26,30-31,33-34,37,57H,5-11,18-22,24-25,44-45H2,1-4H3,(H10-,46,47,48,49,50,51,52,53,58,59,60,61,62,64,65,66,67);(H,6,7)/t26-,30+,31+,33+,34+,37+;/m1./s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

TRS-01 trifluoroacetate

Preferred Name

English

Dazdotuftide trifluoroacetate

Common Name

English

L-Tyrosine, L-threonyl-L-lysyl-L-prolyl-L-arginylglycyl-3-[(1E)-2-[4-[[hydroxy[2-(trimethylammonio)ethoxy]phosphinyl]oxy]phenyl]diazenyl]-, inner salt, 2,2,2-trifluoroacetate

Systematic Name

English

4-((E)-(5-(2-(2-((S)-2-((S)-1-(L-THREONYL-L-LYSYL)PYRROLIDINE-2-CARBOXAMIDO)-5-GUANIDINOPENTANAMIDO)ACETAMIDO)-2-CARBOXYETHYL)-2-HYDROXYPHENYL)DIAZENYL)PHENYL (2-(TRIMETHYLAMMONIO)ETHYL) PHOSPHATE, TRIFLUOROACETATE SALT

Systematic Name

English

TRS01 trifluoroacetate

Code

English

Code System Code Type Description

PUBCHEM

163203567

Created by admin on Wed Apr 02 02:12:16 GMT 2025 , Edited by admin on Wed Apr 02 02:12:16 GMT 2025

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CAS

2522933-45-3

Created by admin on Wed Apr 02 02:12:16 GMT 2025 , Edited by admin on Wed Apr 02 02:12:16 GMT 2025

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FDA UNII

I35XEI0JIK

Created by admin on Wed Apr 02 02:12:16 GMT 2025 , Edited by admin on Wed Apr 02 02:12:16 GMT 2025

PRIMARY

SMS_ID

300000046822

Created by admin on Wed Apr 02 02:12:16 GMT 2025 , Edited by admin on Wed Apr 02 02:12:16 GMT 2025

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SUBSTANCE RECORD


					I35XEI0JIK

Dazdotuftide trifluoroacetate