Fmoc-3-[[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methylbutyl]amino]-L-alanine
Properties
- Molecular formula
- C31H36N2O6
- Molar mass
- 532.64 g/mol
- Exact mass
- 532.2573 Da
- logP
- 5.67Crippen estimate
- Polar surface area
- 125.3 Ų
- H-bond donors / acceptors
- 3 / 6
- Rotatable bonds
- 9
- Stereocentres
- Sin SMILES atom order
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library
Identifiers
CAS number
607366-20-1SMILES
CC(C)CC(=NC[C@@H](C(=O)O)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)C4=C(CC(CC4=O)(C)C)OInChIKey
LCZQXABUYLYUPK-VWLOTQADSA-NInChI
InChI=1S/C31H36N2O6/c1-18(2)13-24(28-26(34)14-31(3,4)15-27(28)35)32-16-25(29(36)37)33-30(38)39-17-23-21-11-7-5-9-19(21)20-10-6-8-12-22(20)23/h5-12,18,23,25,34H,13-17H2,1-4H3,(H,33,38)(H,36,37)/t25-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Fmoc-dap(ivDde)-OH
Work with Fmoc-3-[[1-(4,4-dimethyl-2,6-dioxocyclohexylidene)-3-methylbutyl]amino]-L-alanine
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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds