CFam Chemical Families Database
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You are searching for "CFAMM00528201" in compound.

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CFAM Mol ID CFAMM00528201
Family CFFBM46632 Tyrosine-protein phosphatase non-receptor type 2 and Tyrosine-protein phosphatase non-receptor type 1 ligand 2-[5-[(4aR,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl]pentanoylamino]-3-(3-methoxyphenyl)propanoic acid family
Superfamily CFSBM14662 Tyrosine-protein phosphatase non-receptor type 1 and Tyrosine-protein phosphatase non-receptor type 2 Binder Superfamily 7
Class CFCID697 Class 2047
External ID CHEMBL448797 External Source CHEMBL
PubChem CID 44563390 Functional Category Bioactive
Molecule Name 2-[5-[(4aR,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl]pentanoylamino]-3-(3,5-dimethoxyphenyl)propanoic acid
IUPAC Name 2-[5-[(4aR,6aR,6aS,6bR,8aR,10S,12aR,14bR)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicen-4a-yl]pentanoylamino]-3-(3,5-dimethoxyphenyl)propanoic acid
Synonyms CHEBI:553696
InChi InChI=1S/C45H69NO6/c1-40(2)20-22-45(17-11-10-12-38(48)46-34(39(49)50)26-29-24-30(51-8)27-31(25-29)52-9)23-21-43(6)32(33(45)28-40)13-14-36-42(5)18-16-37(47)41(3,4)35(42)15-19-44(36,43)7/h13,24-25,27,33-37,47H,10-12,14-23,26,28H2,1-9H3,(H,46,48)(H,49,50)/t33-,34?,35-,36+,37-,42-,43+,44+,45+/m0/s1
Formula C45H69NO6 Molecular Weight 720.03
Cross Link CHEMBL448797

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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