AG01EO9G

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CAS Number	1797406-80-4
Catalog Number	AG01EO9G(AGN-PC-3H46AG)
Chemical Name	E3 ligase Ligand-Linker Conjugates 12
IUPAC Name	(2S,4R)-1-[(2S)-2-[[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide
InChI	InChI=1S/C30H43N7O7S/c1-20-26(45-19-33-20)22-7-5-21(6-8-22)16-32-28(40)24-15-23(38)17-37(24)29(41)27(30(2,3)4)35-25(39)18-44-14-13-43-12-11-42-10-9-34-36-31/h5-8,19,23-24,27,38H,9-18H2,1-4H3,(H,32,40)(H,35,39)/t23-,24+,27-/m1/s1
InChI Key	MZOMHQGOVGODTD-ONBPZOJHSA-N
MDL Number	MFCD31807299
Molecular Formula	C30H43N7O7S
Molecular Weight	645.7701
SMILES	C([C@@H](NC(COCCOCCOCCN=[N+]=[N-])=O)[C@](C)(C)C)(=O)N1[C@H](C(NCC2=CC=C(C=C2)C=3SC=NC3C)=O)C[C@@H](O)C1
Synonyms	E3 ligase Ligand-Linker Conjugates 12, SCHEMBL18076359, CS-7734, 1797406-80-4, HY-103598,

Complexity	1000
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	645.294g/mol
Formal Charge	0
Heavy Atom Count	45
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	645.776g/mol
Monoisotopic Mass	645.294g/mol
Rotatable Bond Count	18
Topological Polar Surface Area	182A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

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CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited