Loxistatin

C17H30N2O5CAS 88321-09-9342.44 g/mol

OOOONHONH
EpoxideEsterEther

Properties

Molecular formula
C17H30N2O5
Molar mass
342.44 g/mol
Exact mass
342.2155 Da
logP
2.69Crippen estimate
Polar surface area
104.0 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
10
Stereocentres
S, S, Sin SMILES atom order

Identifiers

CAS number
88321-09-9
SMILES
CCOC(=O)[C@H]1O[C@@H]1C(O)=N[C@@H](CC(C)C)C(O)=NCCC(C)C
InChIKey
SRVFFFJZQVENJC-IHRRRGAJSA-N
InChI
InChI=1S/C17H30N2O5/c1-6-23-17(22)14-13(24-14)16(21)19-12(9-11(4)5)15(20)18-8-7-10(2)3/h10-14H,6-9H2,1-5H3,(H,18,20)(H,19,21)/t12-,13-,14-/m0/s1

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

Names and synonyms

12 names
  • 2-Oxiranecarboxylic acid, 3-[[[(1S)-3-methyl-1-[[(3-methylbutyl)amino]carbonyl]butyl]amino]carbonyl]-, ethyl ester, (2S,3S)-
  • Oxiranecarboxylic acid, 3-[[[3-methyl-1-[[(3-methylbutyl)amino]carbonyl]butyl]amino]carbonyl]-, ethyl ester, [2S-[2α,3β(R*)]]-
  • Oxiranecarboxylic acid, 3-[[[(1S)-3-methyl-1-[[(3-methylbutyl)amino]carbonyl]butyl]amino]carbonyl]-, ethyl ester, (2S,3S)-
  • EP 453
  • EST
  • E 64d
  • E 64c Ethyl ester
  • Aloxistatin
  • EST (pharmaceutical)
  • NSC 694281
  • Pepstatin E64d
  • E64d/Pepstatin

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Similar compounds

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

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