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Fmoc-Cys (Pam) -OH

CAT: 0127-OR1103107-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1103107-01Size:100 mg
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CAS Number
824955-27-3
MDL Number
MFCD02094405
Purity
95%
Smiles
CCCCCCCCCCCCCCCC (SC[C@@H] (C (O) =O) NC (OCC1C2=C (C3=C1C=CC=C3) C=CC=C2) =O) =O

Chemical Information

Fmoc-l-cys(palm)-oh
CAS Number824955-27-3
PubChem CID11786568
IUPAC Name(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-hexadecanoylsulfanylpropanoic acid
Molecular FormulaC34H47NO5S
Molecular Weight581.8
XLogP10.4
Topological Polar Surface Area118
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count22
Heavy Atom Count41
Formal Charge0
Complexity754
SMILES
CCCCCCCCCCCCCCCC(=O)SC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChI
InChI=1S/C34H47NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-32(36)41-25-31(33(37)38)35-34(39)40-24-30-28-21-17-15-19-26(28)27-20-16-18-22-29(27)30/h15-22,30-31H,2-14,23-25H2,1H3,(H,35,39)(H,37,38)/t31-/m0/s1
InChIKey
LIVQOYPTIAPEAG-HKBQPEDESA-N
Chemical Structure
2D Structure
2D structure of Fmoc-l-cys(palm)-oh
CAS: 824955-27-3
CID: 11786568
Formula: C34H47NO5S
MW: 581.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight581.8
XLogP310.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count22
Exact Mass581.31749477
Monoisotopic Mass581.31749477
Topological Polar Surface Area118 Ų
Heavy Atom Count41
Formal Charge0
Complexity754
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes