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You are searching for "CFAMM00225914" in compound. Total 1 results found.
Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.
CFAM Mol ID | CFAMM00225914 |
Family | CFFID1044 Beta-secretase 1 Inhibitor MMI-175 Family |
Superfamily | CFSCD52 Puromycin-sensitive aminopeptidase Inhibitor CHR-2797 Superfamily |
Class | CFCCD46 Class 859 |
External ID | CHEMBL353204 |
External Source | CHEMBL |
PubChem CID |
44380729 |
Functional Category |
Bioactive |
Molecule Name |
tert-butyl N-[(1S)-1-[3-[2-[[(3R)-5-[[(2S)-1-(benzylamino)-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]amino]-2-oxoethyl]oxiran-2-yl]-2-phenylethyl]carbamate |
IUPAC Name |
tert-butyl N-[(1S)-1-[3-[2-[[(3R)-5-[[(2S)-1-(benzylamino)-4-methyl-1-oxopentan-2-yl]amino]-1-cyclohexyl-3-hydroxy-5-oxopentan-2-yl]amino]-2-oxoethyl]oxiran-2-yl]-2-phenylethyl]carbamate |
Synonyms |
CHEBI:380928 |
InChi |
InChI=1S/C41H60N4O7/c1-27(2)21-33(39(49)42-26-30-19-13-8-14-20-30)44-36(47)24-34(46)31(22-28-15-9-6-10-16-28)43-37(48)25-35-38(51-35)32(23-29-17-11-7-12-18-29)45-40(50)52-41(3,4)5/h7-8,11-14,17-20,27-28,31-35,38,46H,6,9-10,15-16,21-26H2,1-5H3,(H,42,49)(H,43,48)(H,44,47)(H,45,50)/t31?,32-,33-,34+,35?,38?/m0/s1 |
InChiKey |
FGLRBWJRHKMZBP-PVRPMRCRSA-N |
Formula | C41H60N4O7 |
Molecular Weight | 720.94 |
Cross Link | CHEMBL353204 |
Structure |
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Statistics of CFAM Database |
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes. |
How to cite our database |
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering.
Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
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Last update by |
2014.08.29
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Dr.
Chen Yuzong
Deputy
Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore
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