Fmoc-L-statine

C23H27NO5CAS 158257-40-0397.47 g/mol

Open in Covalent MOL file
OHOHONHOO
AlcoholCarbamateCarboxylic acid

Properties

Molecular formula
C23H27NO5
Molar mass
397.47 g/mol
Exact mass
397.1889 Da
logP
3.78Crippen estimate
Polar surface area
95.9 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
8
Stereocentres
S, Sin 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
158257-40-0
SMILES
CC(C)C[C@@H]([C@H](CC(=O)O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13
InChIKey
JGUYYODGVQXZAY-SFTDATJTSA-N
InChI
InChI=1S/C23H27NO5/c1-14(2)11-20(21(25)12-22(26)27)24-23(28)29-13-19-17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14,19-21,25H,11-13H2,1-2H3,(H,24,28)(H,26,27)/t20-,21-/m0/s1

Weigh it out

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

Names and synonyms

1 names
  • Fmoc-sta-oh

Work with Fmoc-L-statine

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-L-beta-homoleucine193887-44-474 % similar (R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-methylpentanoic acid172695-33-970 % similar Fmoc-L-beta-homoalanine193954-26-667 % similar Fmoc-L-aspartic acid119062-05-463 % similar Fmoc-D-asp-oh136083-57-363 % similar (2R)-2-(((9H-Fluoren-9-ylmethoxy)carbonyl)amino)-4-methylpentanoic acid114360-54-261 % similar Fmoc-L-leucinol139551-83-060 % similar Fmoc-(S)-3-amino-3-phenylpropionic acid209252-15-360 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Nalpha-((9H-Fluoren-9-ylmethoxy)carbonyl)-L-threonine tert-Butyl Ester120791-76-6 Fmoc-O-tert-butyl-D-threonine138797-71-4 Fmoc-D-allo-thr(tbu)-oh170643-02-4 N-Fmoc-N-methyl-O-tert-butyl-L-serine197632-77-2 Fmoc-allo-thr(tbu)-oh201481-37-0 (R)-3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-4-(tert-butoxy)butanoic acid203854-51-7 N-(9-Fluorenylmethoxycarbonyl)-O-tert-butylthreonine71989-35-0 (S)-Fmoc-2-amino-3-tert-butoxy-2-methyl-propionic acid914399-98-7

Elsewhere

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