chempirical

Fmoc-asp(ompe)-oh

C25H29NO6CAS 180675-08-5439.51 g/mol

Open in Covalent MOL file
OOOOHNHOO
CarbamateCarboxylic acidEster

Properties

Molecular formula
C25H29NO6
Molar mass
439.51 g/mol
Exact mass
439.1995 Da
logP
4.49Crippen estimate
Polar surface area
101.9 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
9
Stereocentres
Sin SMILES atom order

Identifiers

CAS number
180675-08-5
SMILES
CCC(C)(CC)OC(=O)C[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChIKey
SYGKUYKLHYQKPL-NRFANRHFSA-N
InChI
InChI=1S/C25H29NO6/c1-4-25(3,5-2)32-22(27)14-21(23(28)29)26-24(30)31-15-20-18-12-8-6-10-16(18)17-11-7-9-13-19(17)20/h6-13,20-21H,4-5,14-15H2,1-3H3,(H,26,30)(H,28,29)/t21-/m0/s1

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Type any one amount. The others follow from the molar mass.

Work with Fmoc-asp(ompe)-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

Boc-asp(ofm)-oh117014-32-172 % similar Fmoc-L-aspartic acid119062-05-468 % similar Fmoc-asp(ochex)-oh130304-80-265 % similar 9-Fluorenylmethyloxycarbonyl-D-Ser(t-butyl)-OH128107-47-164 % similar Boc-glu(ofm)-oh123417-18-563 % similar Fmoc-D-cys(tbu)-oh131766-22-862 % similar Fmoc-D-orn(boc)-oh118476-89-462 % similar Fmoc-D-ser-oh116861-26-861 % similar

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

Same formula

(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-6-(tert-butoxy)-6-oxohexanoic acid159751-47-0 Fmoc-N-methyl-L-glutamic acid 5-tert-butyl ester200616-40-6 Fmoc-beta-Hoglu(Otbu)-OH203854-49-3

Elsewhere

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