CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00056306" in compound.

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CFAM Mol ID CFAMM00056306
Family CFFAD398 Glucan synthesis regulatory protein Inhibitor Caspofungin Family
Superfamily CFSAD344 Glucan synthesis regulatory protein Inhibitor Caspofungin Superfamily
Class CFCAD323 Class 323
External ID CHEMBL299029 External Source CHEMBL
PubChem CID 44299405 Functional Category Bioactive
Molecule Name (2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-[(2-methylpropan-2-yl)oxy]butanoic acid
IUPAC Name (2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoyl]amino]-3-[(2-methylpropan-2-yl)oxy]butanoic acid
Synonyms CHEBI:187053
InChi InChI=1S/C37H54N6O10/c1-21(2)16-27(35(50)43-31(36(51)52)22(3)53-37(4,5)6)41-34(49)28(18-23-10-8-7-9-11-23)40-30(46)19-39-33(48)29(20-44)42-32(47)26(38)17-24-12-14-25(45)15-13-24/h7-15,21-22,26-29,31,44-45H,16-20,38H2,1-6H3,(H,39,48)(H,40,46)(H,41,49)(H,42,47)(H,43,50)(H,51,52)/t22-,26+,27+,28+,29-,31+/m1/s1
Formula C37H54N6O10 Molecular Weight 742.86
Cross Link CHEMBL299029

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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