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You are searching for "CFAMM00436224" 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 | CFAMM00436224 |
Family | CFFBM15872 Somatostatin receptor type 2 ligand tert-butyl (2S)-6-amino-2-[[(2R)-2-[[4-(benzenesulfonyl)piperazine-1-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoate family |
Superfamily | CFSBM3939 Carbonic anhydrase 1 and Carbonic anhydrase 2 Binder Superfamily 17 |
Class | CFCID835 Class 2185 |
External ID | CHEMBL91696 |
External Source | CHEMBL |
PubChem CID |
44325409 |
Functional Category |
Bioactive |
Molecule Name |
tert-butyl (2S)-6-amino-2-[[(2R)-3-(1H-indol-3-yl)-2-[[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]amino]propanoyl]amino]hexanoate |
IUPAC Name |
tert-butyl (2S)-6-amino-2-[[(2R)-3-(1H-indol-3-yl)-2-[[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]amino]propanoyl]amino]hexanoate |
Synonyms |
CHEBI:250150 |
InChi |
InChI=1S/C33H46N6O6S/c1-23-12-14-25(15-13-23)46(43,44)39-19-17-38(18-20-39)32(42)37-29(21-24-22-35-27-10-6-5-9-26(24)27)30(40)36-28(11-7-8-16-34)31(41)45-33(2,3)4/h5-6,9-10,12-15,22,28-29,35H,7-8,11,16-21,34H2,1-4H3,(H,36,40)(H,37,42)/t28-,29+/m0/s1 |
InChiKey |
KSVPPPPQZURBAT-URLMMPGGSA-N |
Formula | C33H46N6O6S |
Molecular Weight | 654.82 |
Cross Link | CHEMBL91696 |
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. |
How to cite our database |
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 |
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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