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You are searching for "CFAMM00071732" 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 | CFAMM00071732 |
| Family | CFFAD515 HIV-1 protease Inhibitor Lopinavir Family |
| Superfamily | CFSAD447 HIV-1 protease Inhibitor Lopinavir Superfamily |
| Class | CFCAD412 Class 412 |
| External ID | CHEMBL60386 |
External Source | CHEMBL |
| PubChem CID |
44303299 |
Functional Category |
Bioactive |
| Molecule Name |
2-adamantyl N-[1-[[(1R,2R)-1,3-dihydroxy-1-phenylpropan-2-yl]amino]-2-methyl-1-oxo-3-(4-phenoxyphenyl)propan-2-yl]carbamate |
| IUPAC Name |
2-adamantyl N-[1-[[(1R,2R)-1,3-dihydroxy-1-phenylpropan-2-yl]amino]-2-methyl-1-oxo-3-(4-phenoxyphenyl)propan-2-yl]carbamate |
| Synonyms |
CHEBI:195539 |
| InChi |
InChI=1S/C36H42N2O6/c1-36(34(41)37-31(22-39)32(40)26-8-4-2-5-9-26,21-23-12-14-30(15-13-23)43-29-10-6-3-7-11-29)38-35(42)44-33-27-17-24-16-25(19-27)20-28(33)18-24/h2-15,24-25,27-28,31-33,39-40H,16-22H2,1H3,(H,37,41)(H,38,42)/t24?,25?,27?,28?,31-,32-,33?,36?/m1/s1 |
| InChiKey |
VHOQDNPOIXMPOB-DJZXVRBHSA-N |
| Formula | C36H42N2O6 |
Molecular Weight | 598.73 |
| Cross Link | CHEMBL60386 |
| 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.
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How to cite our database |
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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 |
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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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