TT-235

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C51H77N15O11S3
Molecular Weight	1172.446
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC[C@H](C)[C@@H]1NC(=O)[C@@H](CC2=CNC3=C2C=CC=C3)NC(=O)CC4(CCSCC4)SSC(C)(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N5CCC[C@H]5C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(N)=O

InChI

InChIKey=GWVQMNWWXBZHOF-GEOLMOSMSA-N

InChI=1S/C51H77N15O11S3/c1-5-27(2)40-47(76)62-32(14-15-36(52)67)43(72)63-34(23-37(53)68)45(74)65-41(48(77)66-19-9-13-35(66)46(75)61-31(12-8-18-57-49(55)56)42(71)59-26-38(54)69)50(3,4)79-80-51(16-20-78-21-17-51)24-39(70)60-33(44(73)64-40)22-28-25-58-30-11-7-6-10-29(28)30/h6-7,10-11,25,27,31-35,40-41,58H,5,8-9,12-24,26H2,1-4H3,(H2,52,67)(H2,53,68)(H2,54,69)(H,59,71)(H,60,70)(H,61,75)(H,62,76)(H,63,72)(H,64,73)(H,65,74)(H4,55,56,57)/t27-,31-,32-,33+,34-,35-,40-,41+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C51H77N15O11S3
Molecular Weight	1172.446
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	8 / 8
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:57:33 GMT 2025` Edited by `admin` on `Mon Mar 31 20:57:33 GMT 2025`
Record UNII	JGJ45DL6SN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

TT-235

Common Name

English

TT 235

Preferred Name

English

(2S)-1-((10R,13S,16S,19S,22R)-19-(2-AMINO-2-OXO-ETHYL)-16-(3-AMINO-3-OXO-PROPYL)-10-(1H-INDOL-3-YLMETHYL)-23,23-DIMETHYL-13-((1S)-1-METHYLPROPYL)-8,11,14,17,20-PENTAOXO-3,24,25-TRITHIA-9,12,15,18,21-PENTAZASPIRO(5.19)PENTACOSANE-22-CARBONYL)-N-((1S)-1-((

Systematic Name

English

ANTAG III

Common Name

English

GLYCINAMIDE, N-(2-(TETRAHYDRO-4-MERCAPTO-2H-THIOPYRAN-4-YL)ACETYL)-D-TRYPTOPHYL-L-ISOLEUCYL-L-GLUTAMINYL-L-ASPARAGINYL-3-MERCAPTO-L-VALYL-L-PROLYL-L-ARGINYL-, CYCLIC (1->5)-DISULFIDE

Systematic Name

English

Code System Code Type Description

CAS

161185-17-7

Created by admin on Mon Mar 31 20:57:33 GMT 2025 , Edited by admin on Mon Mar 31 20:57:33 GMT 2025

PRIMARY

PUBCHEM

9919956

Created by admin on Mon Mar 31 20:57:33 GMT 2025 , Edited by admin on Mon Mar 31 20:57:33 GMT 2025

PRIMARY

FDA UNII