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You are searching for "CFAMM00571197" 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 | CFAMM00571197 |
| Family | CFFNP3633 Putative NP ZINC40310254 Family |
| Superfamily | CFSID494 Histamine H3 receptor and Alpha-2A adrenergic receptor Binder Superfamily |
| Class | CFCID321 Class 1671 |
| External ID | ZINC32123785 |
External Source | ZINC |
| PubChem CID |
39377484 |
Functional Category |
Natural Product |
| Molecule Name |
methyl (2S)-2-[[(4R)-4-(2,5-dimethoxyphenyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-3-ium-5-carbonyl]amino]-4-methylsulfanylbutanoate |
| IUPAC Name |
methyl (2S)-2-[[(4R)-4-(2,5-dimethoxyphenyl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridin-3-ium-5-carbonyl]amino]-4-methylsulfanylbutanoate |
| Synonyms |
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| InChi |
InChI=1S/C21H28N4O5S/c1-28-13-5-6-17(29-2)14(11-13)19-18-15(22-12-23-18)7-9-25(19)21(27)24-16(8-10-31-4)20(26)30-3/h5-6,11-12,16,19H,7-10H2,1-4H3,(H,22,23)(H,24,27)/p+1/t16-,19+/m0/s1 |
| InChiKey |
YCGASKNDNDLWJH-QFBILLFUSA-O |
| Formula | C21H29N4O5S+ |
Molecular Weight | 449.54 |
| Cross Link | |
| 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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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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