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Details

Stereochemistry ABSOLUTE
Molecular Formula C41H43NO6S
Molecular Weight 677.848
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of O-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethyl]-N-(triphenylmethyl)-D-tyrosine 1,1-dimethylethyl ester

SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C[C@@H](NC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)OC(C)(C)C)C=C2

InChI

InChIKey=KSGPTMKBCVMBBB-KXQOOQHDSA-N
InChI=1S/C41H43NO6S/c1-31-20-26-37(27-21-31)49(44,45)47-29-28-46-36-24-22-32(23-25-36)30-38(39(43)48-40(2,3)4)42-41(33-14-8-5-9-15-33,34-16-10-6-11-17-34)35-18-12-7-13-19-35/h5-27,38,42H,28-30H2,1-4H3/t38-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
D-Tyrosine, O-[2-[[(4-methylphenyl)sulfonyl]oxy]ethyl]-N-(triphenylmethyl)-, 1,1-dimethylethyl ester
Preferred Name English
O-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethyl]-N-(triphenylmethyl)-D-tyrosine 1,1-dimethylethyl ester
Systematic Name English
tert-Butyl (2R)-3-[4-[2-(4-methylphenyl)sulfonyloxyethoxy]phenyl]-2-(tritylamino)propanoate
Systematic Name English
Code System Code Type Description
CAS
2185810-95-9
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
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FDA UNII
574BFH3AAA
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
PRIMARY
PUBCHEM
124597074
Created by admin on Wed Apr 02 19:59:59 GMT 2025 , Edited by admin on Wed Apr 02 19:59:59 GMT 2025
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