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Pam3-Cys-OH 25mg

CAT: 0628-A23387-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0628-A23387-25Size:25 mg
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CAS Number
87420-41-5

Chemical Information

2,3-Bis(palmitoyloxy)-2-propyl-1-palmitoylcysteine

intermediate for immunogen preparation

CAS Number87420-41-5
PubChem CID135926
IUPAC Name(2R)-3-[2,3-di(hexadecanoyloxy)propylsulfanyl]-2-(hexadecanoylamino)propanoic acid
Molecular FormulaC54H103NO7S
Molecular Weight910.5
XLogP21.6
Topological Polar Surface Area144
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count53
Heavy Atom Count63
Formal Charge0
Complexity1030
SMILES
CCCCCCCCCCCCCCCC(=O)N[C@@H](CSCC(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC)C(=O)O
InChI
InChI=1S/C54H103NO7S/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-51(56)55-50(54(59)60)48-63-47-49(62-53(58)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)46-61-52(57)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h49-50H,4-48H2,1-3H3,(H,55,56)(H,59,60)/t49?,50-/m0/s1
InChIKey
PZFZLRNAOHUQPH-GOOVXGPGSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Bis(palmitoyloxy)-2-propyl-1-palmitoylcysteine
CAS: 87420-41-5
CID: 135926
Formula: C54H103NO7S
MW: 910.5
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight910.5
XLogP321.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count53
Exact Mass909.74552580
Monoisotopic Mass909.74552580
Topological Polar Surface Area144 Ų
Heavy Atom Count63
Formal Charge0
Complexity1030
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS3847967-01Pam3-Cys-OH
HY-P4802Pam3-Cys-Ala-Gly
E-3710.0100Ac-Cys-OH
5-06390Fmoc-Cys-OH
sc-239393Boc-Cys-OH
A7132-100000H-Cys-OH
4001680.0005(Boc-Cys-OH) ₂
4011808.0001(Fmoc-Cys-OH) ₂
4017817.0001(Ac-Cys-OH) ₂
448362-01Eptifibatide (Cys-OH)

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