AG00FB64

Name: Gluten Exorphin B5
Brand: Angene Chemical
SKU: AG00FB64

68382-18-3 | Gluten Exorphin B5

AG00FB64

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CAS Number	68382-18-3
Catalog Number	AG00FB64(AGN-PC-0OGJYB)
Chemical Name	Gluten Exorphin B5
IUPAC Name	(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-4-methylpentanoic acid
InChI	InChI=1S/C30H38N6O7/c1-17(2)11-25(30(42)43)36-29(41)24(13-19-14-32-23-6-4-3-5-21(19)23)35-27(39)16-33-26(38)15-34-28(40)22(31)12-18-7-9-20(37)10-8-18/h3-10,14,17,22,24-25,32,37H,11-13,15-16,31H2,1-2H3,(H,33,38)(H,34,40)(H,35,39)(H,36,41)(H,42,43)/t22-,24-,25-/m0/s1
InChI Key	RLDBWDFQAZNDLP-HVCNVCAESA-N
MDL Number	MFCD00237076
Molecular Formula	C30H38N6O7
Molecular Weight	594.6587
SMILES	CC(C)C[C@@H](C(=O)O)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)CNC(=O)CNC(=O)[C@H](CC3=CC=C(C=C3)O)N
Synonyms	exorphin B5, Tyr-Gly-Gly-Trp-Leu, tyrosyl-glycyl-glycyl-tryptophyl-leucine, YGGWL, Gluten Exorphin B5, Tyr-Gly-Gly-Trp-Leu, CHEMBL3250194, MFCD00237076, 68382-18-3, CID9938501, CID 9938501,

Complexity	971
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	594.28g/mol
Formal Charge	0
Heavy Atom Count	43
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	8
Isotope Atom Count	0
Molecular Weight	594.669g/mol
Monoisotopic Mass	594.28g/mol
Rotatable Bond Count	15
Topological Polar Surface Area	216A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

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