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You are searching for "CFAMM00006271" 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 | CFAMM00006271 |
| Family | CFFAD23 Sodium-dependent dopamine transporter inhibitor substituted phenethylamine derivative Methylphenidate family |
| Superfamily | CFSAD23 Sodium-dependent dopamine transporter inhibitor substituted phenethylamine derivative Methylphenidate Superfamily |
| Class | CFCAD23 Class 23 |
| External ID | CHEMBL597270 |
External Source | CHEMBL |
| PubChem CID |
46230994 |
Functional Category |
Bioactive |
| Molecule Name |
[(1S)-2-[(2S,6R)-1-methyl-6-phenacylpiperidin-2-yl]-1-phenylethyl] propanoate;hydrochloride |
| IUPAC Name |
[(1S)-2-[(2S,6R)-1-methyl-6-phenacylpiperidin-2-yl]-1-phenylethyl] propanoate;hydrochloride |
| Synonyms |
CHEBI:700396 |
| InChi |
InChI=1S/C25H31NO3.ClH/c1-3-25(28)29-24(20-13-8-5-9-14-20)18-22-16-10-15-21(26(22)2)17-23(27)19-11-6-4-7-12-19;/h4-9,11-14,21-22,24H,3,10,15-18H2,1-2H3;1H/t21-,22+,24+;/m1./s1 |
| InChiKey |
QGUNMAPZPOSWBJ-OEQHGMQKSA-N |
| Formula | C25H32ClNO3 |
Molecular Weight | 429.98 |
| Cross Link | CHEMBL597270 |
| 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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Deputy
Director of Center for Computational Science and Engineering
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National University of Singapore, Singapore
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