CFam Chemical Families Database
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You are searching for "CFAMM00178133" in compound.

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CFAM Mol ID CFAMM00178133
Family CFFID65 Flovagatran family
Superfamily CFSID50 Cathepsin B and Cathepsin L1 Binder Superfamily
Class CFCAD610 Class 610
External ID CHEMBL45178 External Source CHEMBL
PubChem CID 44291732 Functional Category Bioactive
Molecule Name (3S)-3-[[2-[[(2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]acetyl]amino]-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
IUPAC Name (3S)-3-[[2-[[(2S)-5-(diaminomethylideneamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]acetyl]amino]-4-[[(2S)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
Synonyms CHEBI:169251
InChi InChI=1S/C30H39N7O9/c1-45-28(43)23(15-19-9-4-2-5-10-19)36-27(42)22(16-25(39)40)35-24(38)17-34-26(41)21(13-8-14-33-29(31)32)37-30(44)46-18-20-11-6-3-7-12-20/h2-7,9-12,21-23H,8,13-18H2,1H3,(H,34,41)(H,35,38)(H,36,42)(H,37,44)(H,39,40)(H4,31,32,33)/t21-,22-,23-/m0/s1
Formula C30H39N7O9 Molecular Weight 641.67
Cross Link CHEMBL45178

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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