AG001MS9

150629-67-7 | L-Lysine, N6-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-

AG001MS9

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CAS Number	150629-67-7
Catalog Number	AG001MS9(AGN-PC-0Q50JL)
Chemical Name	L-Lysine, N6-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[1-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)ethylideneamino]hexanoic acid
InChI	InChI=1S/C31H36N2O6/c1-19(28-26(34)16-31(2,3)17-27(28)35)32-15-9-8-14-25(29(36)37)33-30(38)39-18-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h4-7,10-13,24-25,34H,8-9,14-18H2,1-3H3,(H,33,38)(H,36,37)/t25-/m0/s1
InChI Key	AOHSSQNORWQENF-VWLOTQADSA-N
MDL Number	MFCD00278818
Molecular Formula	C31H36N2O6
Molecular Weight	532.6273
SMILES	O=C(O)[C@H](CCCCN/C(C)=C1C(CC(C)(C)CC1=O)=O)NC(OCC2C3=CC=CC=C3C4=CC=CC=C24)=O
Synonyms	Fmoc-Lys(Dde)-OH, 150629-67-7, (S)-2-((((9H-FLUOREN-9-YL)METHOXY)CARBONYL)AMINO)-6-((1-(4,4-DIMETHYL-2,6-DIOXOCYCLOHEXYLIDENE)ETHYL)AMINO)HEXANOIC ACID, FMOC-L-LYS(DDE)-OH, AK-49415, Fmoc-L-Lysine(Dde)-OH, SCHEMBL1983929, N-Fmoc-N'-[1-(4,4-Dimethyl-2,6-dioxocyclohexylidene)ethyl]-D-lysine, KS-00000KCK, DTXSID50448256, ZPSRBXWVBNVFTO-VWLOTQADSA-N, BCP07529, CF-820, MFCD00278818, ZINC100011879, ACN-040890, CS-W022727, AC-27599, AJ-77802, DS-15034, AB0044326, AX8032025, FT-0081957, FT-0651239, 629F677, N-alpha-Fmoc-N-epsilon-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-L-lysine, (2S)-6-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethylamino]-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid, L-Lysine, N6-[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]-N2-[(9H-fluoren-9-ylmethoxy)carbonyl]-, N-ALPHA-(9-FLUORENYLMETHYLOXYCARBONYL)-N-EPSILON-(4,4-DIMETHYL-2,6-DIOXOCYCLOHEX-1-YLIDENE)ETHYL-L-LYSINE, Fmoc-D-Lys(Dde)-OH, N-Fmoc-N'-[1- ethyl]-D-lysine, CB10358, CB12084, CID 4221907, CID10918490, Fmoc-Lys(Dde)-OH, 98% - 1G 1g, A7925,

Complexity	964
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	532.257g/mol
Formal Charge	0
Heavy Atom Count	39
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	532.637g/mol
Monoisotopic Mass	532.257g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	125A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number