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DMT-biotinylated phosphoramidite

CAT: 0931-TSW-01117-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-TSW-01117-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1021702-07-7
Target
Nucleoside Antimetabolite/Analog
Related Pathways
Cell Cycle/Checkpoint, DNA Damage/DNA Repair
Bioactivity
DMT-biotinylated phosphoramidite is a phosphoramidite used in nucleic acid synthesis.
Smiles
C(OCC(COP(N(C(C)C)C(C)C)OCCC#N)CCCCNC(CCCC[C@H]1[C@@]2([C@](CS1)(NC(=O)N2)[H])[H])=O)(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
Molecular Formula
C47H66N5O7PS
Molecular Weight
876.1
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-6-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyhexyl]pentanamide
CAS Number1021702-07-7
PubChem CID15870044
IUPAC Name5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-6-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyhexyl]pentanamide
Molecular FormulaC47H66N5O7PS
Molecular Weight876.1
XLogP7.2
Topological Polar Surface Area169
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count27
Heavy Atom Count61
Formal Charge0
Complexity1300
SMILES
CC(C)N(C(C)C)P(OCCC#N)OCC(CCCCNC(=O)CCCC[C@H]1[C@@H]2[C@H](CS1)NC(=O)N2)COC(C3=CC=CC=C3)(C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC
InChI
InChI=1S/C47H66N5O7PS/c1-34(2)52(35(3)4)60(58-30-14-28-48)59-32-36(15-12-13-29-49-44(53)19-11-10-18-43-45-42(33-61-43)50-46(54)51-45)31-57-47(37-16-8-7-9-17-37,38-20-24-40(55-5)25-21-38)39-22-26-41(56-6)27-23-39/h7-9,16-17,20-27,34-36,42-43,45H,10-15,18-19,29-33H2,1-6H3,(H,49,53)(H2,50,51,54)/t36?,42-,43-,45-,60?/m0/s1
InChIKey
GMVCCUAXEMZEJE-OYSBNFJTSA-N
Chemical Structure
2D Structure
2D structure of 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-6-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyhexyl]pentanamide
CAS: 1021702-07-7
CID: 15870044
Formula: C47H66N5O7PS
MW: 876.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight876.1
XLogP37.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count27
Exact Mass875.44205763
Monoisotopic Mass875.44205763
Topological Polar Surface Area169 Ų
Heavy Atom Count61
Formal Charge0
Complexity1300
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR19266912-01DMT-biotinylated phosphoramidite
MBS5801259DMT-dT Phosphoramidite
AR-M05423-01DMT-locT Phosphoramidite
OR1030848-01DMT-dI Phosphoramidite
HY-W013068S2DMT-dT Phosphoramidite-13C
HY-W013068S1DMT-dT Phosphoramidite-15N2
HY-W013059-01DMT-dA (bz) Phosphoramidite
HY-W008849-01DMT-dC (bz) Phosphoramidite
MBS3616660-01DMT-dG(ib) Phosphoramidite
OR1025504DMT-locMeC (bz) phosphoramidite

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