Fmoc-L-lys(dde)-oh

C₃₁H₃₆N₂O₆CAS 150629-67-7532.64 g/mol

Open in Covalent MOL file

Alkene Carbamate Carboxylic acid Imine Ketone

Properties

Molecular formula: C₃₁H₃₆N₂O₆
Molar mass: 532.64 g/mol
Exact mass: 532.2573 Da
logP: 5.81Crippen estimate
Polar surface area: 125.3 Å²
H-bond donors / acceptors: 3 / 6
Rotatable bonds: 10
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

150629-67-7

SMILES

CC(=NCCCC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C4=C(CC(CC4=O)(C)C)O

InChIKey

AOHSSQNORWQENF-VWLOTQADSA-N

InChI

InChI=1S/C31H36N2O6/c1-19(28-26(34)16-31(2,3)17-27(28)35)32-15-9-8-14-25(29(36)37)33-30(38)39-18-24-22-12-6-4-10-20(22)21-11-5-7-13-23(21)24/h4-7,10-13,24-25,34H,8-9,14-18H2,1-3H3,(H,33,38)(H,36,37)/t25-/m0/s1

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Names and synonyms

1 names

Fmoc-lys(dde)-OH

Work with Fmoc-L-lys(dde)-oh

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Fmoc-D-lys(ivdde)-oh1272755-33-580 % similar Fmoc-orn(ivdde)-oh1198321-33-376 % similar Fmoc-D-nle-oh112883-41-759 % similar Fmoc-D-arg-oh130752-32-859 % similar Fmoc-lys-oh105047-45-856 % similar Fmoc-D-orn(boc)-oh118476-89-455 % similar Boc-glu(ofm)-oh123417-18-554 % similar Fmoc-asp(ochex)-oh130304-80-253 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Dde-lys(fmoc)-oh156648-40-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook