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You are searching for "CFAMM00398407" 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 | CFAMM00398407 |
| Family | CFFBM9862 Pol polyprotein inhibitor SureCN3530080 family |
| Superfamily | CFSBM4975 Pol polyprotein Binder Superfamily 37 |
| Class | CFCBM26 Class 3076 |
| External ID | CHEMBL410469 |
External Source | CHEMBL |
| PubChem CID |
11707444 |
Functional Category |
Bioactive |
| Molecule Name |
SureCN3526432 |
| IUPAC Name |
methyl N-[(2S)-1-[2-[(2S)-2-benzyl-2-hydroxy-3-[[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]amino]-3-oxopropyl]-2-[[3-(2-phenylethynyl)phenyl]methyl]hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate |
| Synonyms |
CHEBI:442347;{(1S)-1-[N'-[3-(Phenylethynyl)-benzyl]-N'-((2S)-2-hydroxy-2-((1S,2R)-2-hydroxy-indan-1-ylcarbamoyl)-3-phenylpropyl)-hydrazinocarbonyl]-2,2-dimethyl-propyl}-carbamic acid methyl ester |
| InChi |
InChI=1S/C42H46N4O6/c1-41(2,3)37(44-40(50)52-4)38(48)45-46(27-32-19-13-18-30(24-32)23-22-29-14-7-5-8-15-29)28-42(51,26-31-16-9-6-10-17-31)39(49)43-36-34-21-12-11-20-33(34)25-35(36)47/h5-21,24,35-37,47,51H,25-28H2,1-4H3,(H,43,49)(H,44,50)(H,45,48)/t35-,36+,37-,42+/m1/s1 |
| InChiKey |
XHJMPUZUZVEPNJ-PAMYEKIESA-N |
| Formula | C42H46N4O6 |
Molecular Weight | 702.84 |
| Cross Link | CHEMBL410469 |
| 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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48709 visits since 2014 .........
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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