CFam Chemical Families Database
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CFAM Mol ID CFAMM00560371
Family CFFNP1464 NP Methyl 2-((3s,3a'r,8a's,8b's)-5-ethyl-1',2,3'-trioxo-3',3a',6',7',8',8a'-hexahydro-1'h-spiro[indoline-3,4'-pyrrolo[3,4-a]pyrrolizine]-2'(8b'h)-yl)benzoate Family
Superfamily CFSNP410 NP 4-((3s,3a'r,8a's,8b's)-5-chloro-7-methyl-1',2,3'-trioxo-3',3a',6',7',8',8a'-hexahydro-1'h-spiro[indoline-3,4'-pyrrolo[3,4-a]pyrrolizine]-2'(8b'h)-yl)phenyl Acetate and NP Methyl 2-((3s,3a'r,8a's,8b's)-7-chloro-5-methyl-1',2,3'-trioxo-3',3a',6',7',8',8a'-hexahydro-1'h-spiro[indoline-3,4'-pyrrolo[3,4-a]pyrrolizine]-2'(8b'h)-yl)benzoate Superfamily
Class CFCBM3732 Class 6782
External ID ZINC33905410 External Source ZINC
PubChem CID 16398339 Functional Category Natural Product
Molecule Name methyl 2-((3S,3a'R,8a'S,8b'S)-1',2,3'-trioxo-3',3a',6',7',8',8a'-hexahydro-1'H-spiro[indoline-3,4'-pyrrolo[3,4-a]pyrrolizine]-2'(8b'H)-yl)benzoate
IUPAC Name methyl 2-[(3S,3'aR,8'aS,8'bS)-1',2,3'-trioxospiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-2'-yl]benzoate
Synonyms MolPort-002-516-934;ZINC33905410
InChi InChI=1S/C24H21N3O5/c1-32-22(30)13-7-2-5-10-16(13)27-20(28)18-17-11-6-12-26(17)24(19(18)21(27)29)14-8-3-4-9-15(14)25-23(24)31/h2-5,7-10,17-19H,6,11-12H2,1H3,(H,25,31)/t17-,18+,19-,24+/m0/s1
Formula C24H21N3O5 Molecular Weight 431.44
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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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