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You are searching for "CFAMM00190220" 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 | CFAMM00190220 |
| Family | CFFID385 Prothrombin Inhibitor LB30812 Family |
| Superfamily | CFSID7 Prothrombin and Neuropeptide Y receptor type 1 Binder Superfamily |
| Class | CFCID4 Class 1354 |
| External ID | CHEMBL18055 |
External Source | CHEMBL |
| PubChem CID |
44271702 |
Functional Category |
Bioactive |
| Molecule Name |
(6S,8aS)-2-benzhydrylsulfonyl-N-(5-carbamimidoyl-2,3-dihydro-1H-inden-1-yl)-4-oxo-1,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-6-carboxamide |
| IUPAC Name |
(6S,8aS)-2-benzhydrylsulfonyl-N-(5-carbamimidoyl-2,3-dihydro-1H-inden-1-yl)-4-oxo-1,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-6-carboxamide |
| Synonyms |
CHEBI:119966 |
| InChi |
InChI=1S/C31H33N5O4S/c32-30(33)23-11-14-25-22(17-23)12-15-26(25)34-31(38)27-16-13-24-18-35(19-28(37)36(24)27)41(39,40)29(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-11,14,17,24,26-27,29H,12-13,15-16,18-19H2,(H3,32,33)(H,34,38)/t24-,26?,27-/m0/s1 |
| InChiKey |
YHXWUDONUMFBDD-VNBODJOOSA-N |
| Formula | C31H33N5O4S |
Molecular Weight | 571.69 |
| Cross Link | CHEMBL18055 |
| 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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