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Fmoc-Lys (Boc) -Pro-OH

CAT: 0127-OR36488Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR36488Size:5 g
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CAS Number
130445-10-2
MDL Number
MFCD18427305
Purity
=95%
Smiles
CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)OCC1c2ccccc2c3ccccc13)C(=O)N4CCC[C@H]4C(=O)O

Chemical Information

Fmoc-Lys(Boc)-Pro-OH
CAS Number130445-10-2
PubChem CID15234222
IUPAC Name(2S)-1-[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyl]pyrrolidine-2-carboxylic acid
Molecular FormulaC31H39N3O7
Molecular Weight565.7
XLogP4.5
Topological Polar Surface Area134
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Heavy Atom Count41
Formal Charge0
Complexity913
SMILES
CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)N1CCC[C@H]1C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C31H39N3O7/c1-31(2,3)41-29(38)32-17-9-8-15-25(27(35)34-18-10-16-26(34)28(36)37)33-30(39)40-19-24-22-13-6-4-11-20(22)21-12-5-7-14-23(21)24/h4-7,11-14,24-26H,8-10,15-19H2,1-3H3,(H,32,38)(H,33,39)(H,36,37)/t25-,26-/m0/s1
InChIKey
FTDLWHRKZBSRBL-UIOOFZCWSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-Lys(Boc)-Pro-OH
CAS: 130445-10-2
CID: 15234222
Formula: C31H39N3O7
MW: 565.7
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight565.7
XLogP34.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count13
Exact Mass565.27880059
Monoisotopic Mass565.27880059
Topological Polar Surface Area134 Ų
Heavy Atom Count41
Formal Charge0
Complexity913
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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B-4420.0005Fmoc-Lys(Boc)-Pro-OH
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A7922-25000Fmoc-Lys(Boc)-OH
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