Fmoc-D-tryptophan

C26H22N2O4CAS 86123-11-7426.47 g/mol

Open in Covalent MOL file
OONHNHOHO
CarbamateCarboxylic acid

Properties

Molecular formula
C26H22N2O4
Molar mass
426.47 g/mol
Exact mass
426.1580 Da
logP
4.70Crippen estimate
Polar surface area
91.4 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
6
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
86123-11-7
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@H](CC4=CNC5=CC=CC=C54)C(=O)O
InChIKey
MGHMWKZOLAAOTD-XMMPIXPASA-N
InChI
InChI=1S/C26H22N2O4/c29-25(30)24(13-16-14-27-23-12-6-5-7-17(16)23)28-26(31)32-15-22-20-10-3-1-8-18(20)19-9-2-4-11-21(19)22/h1-12,14,22,24,27H,13,15H2,(H,28,31)(H,29,30)/t24-/m1/s1

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Names and synonyms

1 names
  • Fmoc-D-trp-OH

Work with Fmoc-D-tryptophan

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Fmoc-L-tryptophan35737-15-6Enantiomer

Similar compounds

(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(1H-pyrrolo[2,3-b]pyridin-3-yl)propanoic acid737007-45-377 % similar N-Fmoc-7-methyl-L-tryptophan1808268-53-275 % similar Fmoc-L-2-chlorophe198560-41-768 % similar Fmoc-2-chloro-D-phenylalanine205526-22-368 % similar Fmoc-L-2-bromophenylalanine220497-47-268 % similar Fmoc-D-2-bromophenylalanine220497-79-068 % similar Fmoc-phe-oh286460-71-767 % similar Fmoc-D-phenylalanine86123-10-667 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(βS)-2-Cyano-β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]benzenebutanoic acid270065-84-4 (βS)-3-Cyano-β-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]benzenebutanoic acid270065-87-7

Elsewhere

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