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18:1 Biotinyl Cap PE

CAT: 0926-JQA83551-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-JQA83551-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
384835-51-2
Smiles
CCCCCCCCC=CCCCCCCCC (=O) OCC (COP (=O) ([O-]) OCCNC (=O) CCCCCNC (=O) CCCCC1C2C (CS1) NC (=O) N2) OC (=O) CCCCCCCC=CCCCCCCCC.[Na+]
Molecular Formula
C57H102N4O11PNaS
Molecular Weight
1,105.47 g/mol
Controlled
No

Chemical Information

Sodium (2R)-2,3-bis{[(9Z)-octadec-9-enoyl]oxy}propyl 2-{[6-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)hexanoyl]amino}ethyl phosphate
CAS Number384835-51-2
PubChem CID46907854
IUPAC Namesodium 2-[6-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]hexanoylamino]ethyl [(2R)-2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl] phosphate
Molecular FormulaC57H102N4NaO11PS
Molecular Weight1105.5
Topological Polar Surface Area236
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count12
Rotatable Bond Count53
Heavy Atom Count75
Formal Charge0
Complexity1600
SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCNC(=O)CCCC[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2)OC(=O)CCCCCCC/C=C\CCCCCCCC.[Na+]
InChI
InChI=1S/C57H103N4O11PS.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33-41-54(64)69-46-49(72-55(65)42-34-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)47-71-73(67,68)70-45-44-59-53(63)39-32-31-37-43-58-52(62)40-36-35-38-51-56-50(48-74-51)60-57(66)61-56;/h17-20,49-51,56H,3-16,21-48H2,1-2H3,(H,58,62)(H,59,63)(H,67,68)(H2,60,61,66);/q;+1/p-1/b19-17-,20-18-;/t49-,50+,51+,56+;/m1./s1
InChIKey
VQSGNVZURNOPBT-XEAQQBNDSA-M
Chemical Structure
2D Structure
2D structure of Sodium (2R)-2,3-bis{[(9Z)-octadec-9-enoyl]oxy}propyl 2-{[6-({5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoyl}amino)hexanoyl]amino}ethyl phosphate
CAS: 384835-51-2
CID: 46907854
Formula: C57H102N4NaO11PS
MW: 1105.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1105.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count12
Rotatable Bond Count53
Exact Mass1104.69011254
Monoisotopic Mass1104.69011254
Topological Polar Surface Area236 Ų
Heavy Atom Count75
Formal Charge0
Complexity1600
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-W800796-0118:1 Biotinyl PE
HY-W34083218:1 Biotinyl Cap PE
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5-00770Biotin-(Cys1, Lys(biotinyl)18)-Calcitonin (human)
E-PP-0769-01Biotin- (Cys1, Lys (biotinyl) 18) -Calcitonin, human
M40947Biotin- (Cys1, Lys (biotinyl) 18) -Calcitonin (human)
abx265335-01(Cys1, Lys (biotinyl) 18) -Calcitonin (Biotin) Peptide
GTR18890566Human (Cys1, Lys (biotinyl) 18) -Calcitonin Biotin peptide
4038795.1000Biotinyl-Amyloid β-Protein (1-42)
H-7676.1000Biotinyl-ACTH (1-39) (human)

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