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Fmoc-Ala-Ala-Pro-OH

CAT: 0013-GTR19253769-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19253769-01Size:50 mg
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Description
Fmoc-Ala-Ala-Pro-OH is an Fmoc-protected tripeptide linker utilized in the synthesis of antibody-drug conjugates (ADC) .
CAS Number
161220-53-7
Smiles
C (OC (N[C@H] (C (N[C@H] (C (=O) N1[C@H] (C (O) =O) CCC1) C) =O) C) =O) C2C=3C (C=4C2=CC=CC4) =CC=CC3
Molecular Formula
C26H29N3O6
Molecular Weight
479.525
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Fmoc-Ala-Ala-Pro-OH
CAS Number161220-53-7
PubChem CID15282159
IUPAC Name(2S)-1-[(2S)-2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid
Molecular FormulaC26H29N3O6
Molecular Weight479.5
XLogP2.9
Topological Polar Surface Area125
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count35
Formal Charge0
Complexity797
SMILES
C[C@@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C26H29N3O6/c1-15(23(30)27-16(2)24(31)29-13-7-12-22(29)25(32)33)28-26(34)35-14-21-19-10-5-3-8-17(19)18-9-4-6-11-20(18)21/h3-6,8-11,15-16,21-22H,7,12-14H2,1-2H3,(H,27,30)(H,28,34)(H,32,33)/t15-,16-,22-/m0/s1
InChIKey
BEUOECKRMVYVFQ-WCJKSRRJSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-Ala-Ala-Pro-OH
CAS: 161220-53-7
CID: 15282159
Formula: C26H29N3O6
MW: 479.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight479.5
XLogP32.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass479.20563565
Monoisotopic Mass479.20563565
Topological Polar Surface Area125 Ų
Heavy Atom Count35
Formal Charge0
Complexity797
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes