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Fmoc-Thr (Trt) -OH

CAT: 0121-4025725.0005Size: 5 gDry Ice: NoHazardous: No
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CAT#:0121-4025725.0005Size:5 g
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CAS Number
133180-01-5
Specifications
B-2545.0005
Sequence
Fmoc-Thr (Trt) -OH
Molecular Formula
C₃₈H₃₃NO₅
Molecular Weight
583.68
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

O-trityl-L-threonine, N-FMOC protected
CAS Number133180-01-5
PubChem CID11180767
IUPAC Name(2S,3R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-trityloxybutanoic acid
Molecular FormulaC38H33NO5
Molecular Weight583.7
XLogP7.6
Topological Polar Surface Area84.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count44
Formal Charge0
Complexity868
SMILES
C[C@H]([C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)OC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C38H33NO5/c1-26(44-38(27-15-5-2-6-16-27,28-17-7-3-8-18-28)29-19-9-4-10-20-29)35(36(40)41)39-37(42)43-25-34-32-23-13-11-21-30(32)31-22-12-14-24-33(31)34/h2-24,26,34-35H,25H2,1H3,(H,39,42)(H,40,41)/t26-,35+/m1/s1
InChIKey
JARBLLDDSTVWSM-IJAHGLKVSA-N
Chemical Structure
2D Structure
2D structure of O-trityl-L-threonine, N-FMOC protected
CAS: 133180-01-5
CID: 11180767
Formula: C38H33NO5
MW: 583.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight583.7
XLogP37.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass583.23587315
Monoisotopic Mass583.23587315
Topological Polar Surface Area84.9 Ų
Heavy Atom Count44
Formal Charge0
Complexity868
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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5-06914Fmoc-Thr(Trt)-OH
450853-01Fmoc-thr (trt) -oh
450587-01Fmoc-d-thr (trt) -oh
5-06889Fmoc-Thr(tBu)-Cys(Trt)-OH
MBS9023239-01Fmoc-Gln(Trt)-Thr(tBu)-OH
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MBS407479-01Fmoc-Gln(Trt)-Thr(Me,Mepro)-OH
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