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

Details

Stereochemistry ABSOLUTE
Molecular Formula C120H171N23O32S
Molecular Weight 2479.842
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Tezusomant

SMILES

CC(C)[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H]2CCCCNC(=O)CN3C=C(C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC1=O)C(=O)N[C@@H](CC4=CC=C(C=C4)C(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC5=CNC6=C5C=C(O)C=C6)C(=O)NC(C)(C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CSCC(=O)N[C@@H](CC7=CC=C(C=C7)C(O)=O)C(=O)N2C)C(=O)NCCCC[C@H](NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCC(O)=O)C(O)=O)C(O)=O)C(N)=O)C8=C3C=CC=C8)C(C)C

InChI

InChIKey=UUNQJTVHPFMQJB-OMRBBKOSSA-N
InChI=1S/C120H171N23O32S/c1-66(2)99-111(163)136-88(63-144)108(160)135-86(59-92(122)146)107(159)133-84-57-74-61-143(90-33-23-22-30-76(74)90)62-96(150)124-52-29-26-34-91(110(162)138-100(67(3)4)113(165)139-99)142(9)114(166)87(55-70-39-43-72(44-40-70)116(169)170)130-97(151)65-176-64-89(103(155)125-53-28-25-31-79(102(123)154)127-94(148)49-47-82(118(173)174)129-95(149)50-48-81(117(171)172)128-93(147)35-20-18-16-14-12-10-11-13-15-17-19-21-36-98(152)153)137-112(164)101(68(5)6)140-119(175)120(7,8)141-109(161)85(56-73-60-126-78-46-45-75(145)58-77(73)78)134-104(156)80(32-24-27-51-121)131-105(157)83(132-106(84)158)54-69-37-41-71(42-38-69)115(167)168/h22-23,30,33,37-46,58,60-61,66-68,79-89,91,99-101,126,144-145H,10-21,24-29,31-32,34-36,47-57,59,62-65,121H2,1-9H3,(H2,122,146)(H2,123,154)(H,124,150)(H,125,155)(H,127,148)(H,128,147)(H,129,149)(H,130,151)(H,131,157)(H,132,158)(H,133,159)(H,134,156)(H,135,160)(H,136,163)(H,137,164)(H,138,162)(H,139,165)(H,140,175)(H,141,161)(H,152,153)(H,167,168)(H,169,170)(H,171,172)(H,173,174)/t79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,91-,99-,100-,101-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
L-Lysinamide, N-(15-carboxy-1-oxopentadecyl)-L-?-glutamyl-L-?-glutamyl-N6-[4-carboxy-N-(2-mercaptoacetyl)-L-phenylalanyl-N2-methyl-L-lysyl-L-valyl-L-valyl-L-seryl-L-asparaginyl-1-(carboxymethyl)-L-tryptophyl-4-carboxy-L-phenylalanyl-L-lysyl-5-hydroxy-L-t
Preferred Name English
Tezusomant
INN  
Official Name English
N-(15-carboxypentadecanoyl)-L-?-glutamyl-L-?-glutamyl-N<sup>6</sup>-{N<sup>6.2</sup>,C<sup>1.7</sup>-anhydro-S<sup>N.1</sup>,C<sup>3.13</sup>-cyclo[4-carboxy-N-(sulfanylacetyl)-L-phenylalanyl-N<sup>2</sup>-methyl-L-lysyl-L-valyl-L-valyl-L-seryl-L-asparag
Common Name English
tezusomant [INN]
Common Name English
Code System Code Type Description
INN
13406
Created by admin on Wed Apr 02 19:17:04 GMT 2025 , Edited by admin on Wed Apr 02 19:17:04 GMT 2025
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CAS
2802416-72-2
Created by admin on Wed Apr 02 19:17:04 GMT 2025 , Edited by admin on Wed Apr 02 19:17:04 GMT 2025
PRIMARY
FDA UNII
P76WKQ7R9F
Created by admin on Wed Apr 02 19:17:04 GMT 2025 , Edited by admin on Wed Apr 02 19:17:04 GMT 2025
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