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BOC-THR(GLY-FMOC)-OH

CAS No.:
944283-25-4
Catalog Number:
AG00VQY7
Molecular Formula:
C26H30N2O8
Molecular Weight:
498.5250
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Product Description
Catalog Number:
AG00VQY7
Chemical Name:
BOC-THR(GLY-FMOC)-OH
CAS Number:
944283-25-4
Molecular Formula:
C26H30N2O8
Molecular Weight:
498.5250
MDL Number:
MFCD10001360
IUPAC Name:
(2S,3R)-3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)acetyl]oxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C26H30N2O8/c1-15(22(23(30)31)28-25(33)36-26(2,3)4)35-21(29)13-27-24(32)34-14-20-18-11-7-5-9-16(18)17-10-6-8-12-19(17)20/h5-12,15,20,22H,13-14H2,1-4H3,(H,27,32)(H,28,33)(H,30,31)/t15-,22+/m1/s1
InChI Key:
FKRTXLMOZHWXCJ-QRQCRPRQSA-N
SMILES:
O=C(O[C@@H]([C@@H](C(=O)O)NC(=O)OC(C)(C)C)C)CNC(=O)OCC1c2ccccc2c2c1cccc2 C26H30N2O8
Properties
Complexity:
788  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
498.2g/mol
Formal Charge:
0
Heavy Atom Count:
36  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
498.532g/mol
Monoisotopic Mass:
498.2g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
140A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties