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Home > Fluorides > 1315449-98-9
1315449-98-9 | L-Tryptophan, 1-[(1,1-dimethylethoxy)carbonyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-α-methyl-
CAS No: 1315449-98-9 Catalog No: AG000ZDN MDL No:MFCD16652328
Product Description
Catalog Number:
AG000ZDN
Chemical Name:
L-Tryptophan, 1-[(1,1-dimethylethoxy)carbonyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-α-methyl-
CAS Number:
1315449-98-9
Molecular Formula:
C32H32N2O6
Molecular Weight:
540.6063
MDL Number:
MFCD16652328
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyl-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]propanoic acid
InChI:
InChI=1S/C32H32N2O6/c1-31(2,3)40-30(38)34-18-20(21-11-9-10-16-27(21)34)17-32(4,28(35)36)33-29(37)39-19-26-24-14-7-5-12-22(24)23-13-6-8-15-25(23)26/h5-16,18,26H,17,19H2,1-4H3,(H,33,37)(H,35,36)/t32-/m0/s1
InChI Key:
MXKJLYRFMUOEPT-YTTGMZPUSA-N
SMILES:
O=C(N[C@](C(=O)O)(Cc1cn(c2c1cccc2)C(=O)OC(C)(C)C)C)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
926
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
540.226g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
540.616g/mol
Monoisotopic Mass:
540.226g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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