CFam Chemical Families Database
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You are searching for "CFAMM00235027" in compound.

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CFAM Mol ID CFAMM00235027
Family CFFID1300 Plasmepsin-1 Inhibitor SC-5003 Family
Superfamily CFSAD716 Bacterial outer membrane Inhibitor Polymyxin B Superfamily
Class CFCAD607 Class 607
External ID CHEMBL322450 External Source CHEMBL
PubChem CID 10463080 Functional Category Bioactive
Molecule Name benzyl 2-[[(2S,4S,5S)-6-cyclohexyl-4-hydroxy-5-[[(2S)-2-[[(2S)-1-[4-(methoxymethoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]hexanoyl]amino]-2-propan-2-ylhexanoyl]amino]acetate
IUPAC Name benzyl 2-[[(2S,4S,5S)-6-cyclohexyl-4-hydroxy-5-[[(2S)-2-[[(2S)-1-[4-(methoxymethoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]hexanoyl]amino]-2-propan-2-ylhexanoyl]amino]acetate
Synonyms CHEBI:265891
InChi InChI=1S/C46H70N4O8/c1-5-6-22-39(48-41(28-35-18-12-8-13-19-35)46(55)50-25-23-37(24-26-50)58-32-56-4)45(54)49-40(27-34-16-10-7-11-17-34)42(51)29-38(33(2)3)44(53)47-30-43(52)57-31-36-20-14-9-15-21-36/h8-9,12-15,18-21,33-34,37-42,48,51H,5-7,10-11,16-17,22-32H2,1-4H3,(H,47,53)(H,49,54)/t38-,39-,40-,41-,42-/m0/s1
Formula C46H70N4O8 Molecular Weight 807.07
Cross Link CHEMBL322450

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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