CFam Chemical Families Database
BIDD Pharmainformatics Databases
You are searching for "CFAMM00056305" in compound.

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CFAM Mol ID CFAMM00056305
Family CFFAD398 Glucan synthesis regulatory protein Inhibitor Caspofungin Family
Superfamily CFSAD344 Glucan synthesis regulatory protein Inhibitor Caspofungin Superfamily
Class CFCAD323 Class 323
External ID CHEMBL265173 External Source CHEMBL
PubChem CID 44415035 Functional Category Bioactive
Molecule Name 4-[(2S)-3-amino-2-[[(2S,3R)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-(ethylamino)-3-(4-hydroxyphenyl)propyl]amino]-3-(4-hydroxyphenyl)propyl]amino]-3-phenylpropyl]pyrrolidin-2-yl]methylamino]-3-hydroxybutyl]amino]propyl]phenol
IUPAC Name 4-[(2S)-3-amino-2-[[(2S,3R)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-(ethylamino)-3-(4-hydroxyphenyl)propyl]amino]-3-(4-hydroxyphenyl)propyl]amino]-3-phenylpropyl]pyrrolidin-2-yl]methylamino]-3-hydroxybutyl]amino]propyl]phenol
Synonyms CHEBI:456038
InChi InChI=1S/C47H69N7O4/c1-3-49-40(25-37-13-19-45(57)20-14-37)29-50-41(26-38-15-21-46(58)22-16-38)30-51-42(27-35-8-5-4-6-9-35)33-54-23-7-10-43(54)31-53-47(34(2)55)32-52-39(28-48)24-36-11-17-44(56)18-12-36/h4-6,8-9,11-22,34,39-43,47,49-53,55-58H,3,7,10,23-33,48H2,1-2H3/t34-,39+,40+,41+,42+,43+,47+/m1/s1
Formula C47H69N7O4 Molecular Weight 796.10
Cross Link CHEMBL265173

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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