CFam Chemical Families Database
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You are searching for "CFAMM00295483" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00295483
Family CFFID3649 Genome polyprotein Inhibitor Acasp-glu-cha-val-prb-cys Family
Superfamily CFSID2502 Genome polyprotein Inhibitor Acasp-glu-cha-val-prb-cys Superfamily
Class CFCID1483 Class 2833
External ID CHEMBL47532 External Source CHEMBL
PubChem CID 44291380 Functional Category Bioactive
Molecule Name (3S)-4-[[(2S)-3-(1-adamantyl)-1-methoxy-1-oxopropan-2-yl]amino]-3-[(3S)-3-[[(2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxopyrrolidin-1-yl]-4-oxobutanoic acid;2,2,2-trifluoroacetic acid
IUPAC Name (3S)-4-[[(2S)-3-(1-adamantyl)-1-methoxy-1-oxopropan-2-yl]amino]-3-[(3S)-3-[[(2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxopyrrolidin-1-yl]-4-oxobutanoic acid;2,2,2-trifluoroacetic acid
Synonyms CHEBI:168646
InChi InChI=1S/C36H51N7O9.C2HF3O2/c1-51-33(49)27(19-36-16-22-12-23(17-36)14-24(13-22)18-36)41-31(47)28(15-29(44)45)43-11-9-26(32(43)48)40-30(46)25(8-5-10-39-34(37)38)42-35(50)52-20-21-6-3-2-4-7-21;3-2(4,5)1(6)7/h2-4,6-7,22-28H,5,8-20H2,1H3,(H,40,46)(H,41,47)(H,42,50)(H,44,45)(H4,37,38,39);(H,6,7)/t22?,23?,24?,25-,26-,27-,28-,36?;/m0./s1
Formula C38H52F3N7O11 Molecular Weight 839.85
Cross Link CHEMBL47532

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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