Fmoc-ser(tbu)-ser(psime,mepro)-oh

C28H34N2O7CAS 1000164-43-1510.59 g/mol

Open in Covalent MOL file
NOOOHOONHOO
AmideCarbamateCarboxylic acidEther

Properties

Molecular formula
C28H34N2O7
Molar mass
510.59 g/mol
Exact mass
510.2366 Da
logP
3.76Crippen estimate
Polar surface area
114.4 Ų
H-bond donors / acceptors
2 / 6
Rotatable bonds
7
Stereocentres
S, Sin SMILES atom order

Hazards

Not classified as hazardous under GHS. Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
1000164-43-1
SMILES
CC1(N([C@@H](CO1)C(=O)O)C(=O)[C@H](COC(C)(C)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C
InChIKey
OXEDICXRSSILSN-GOTSBHOMSA-N
InChI
InChI=1S/C28H34N2O7/c1-27(2,3)36-15-22(24(31)30-23(25(32)33)16-37-28(30,4)5)29-26(34)35-14-21-19-12-8-6-10-17(19)18-11-7-9-13-20(18)21/h6-13,21-23H,14-16H2,1-5H3,(H,29,34)(H,32,33)/t22-,23-/m0/s1

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Names and synonyms

1 names
  • 4-Oxazolidinecarboxylic acid, 3-((2S)-3-(1,1-dimethylethoxy)-2-(((9H-fluoren-9-ylmethoxy)carbonyl)amino)-1-oxopropyl)-2,2-dimethyl-, (4S)-

Work with Fmoc-ser(tbu)-ser(psime,mepro)-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-phe-ser(psime,mepro)-oh878797-01-480 % similar Fmoc-Glu(OtBu)-Ser(Psi(Me,Me)pro)-OH909115-33-978 % similar Fmoc-ala-ser(yme,mepro)-oh252554-78-277 % similar Fmoc-lys(boc)-ser(psime,mepro)-oh957780-54-075 % similar Fmoc-val-ser(psime,mepro)-oh186023-49-474 % similar Fmoc-ser(tbu)-thr(psime,mepro)-oh1266350-99-574 % similar 9-Fluorenylmethyloxycarbonyl-D-Ser(t-butyl)-OH128107-47-172 % similar Fmoc-Gln(Trt)-Ser(Psi(Me,Me)pro)-OH1821378-64-671 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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