U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C23H24N2O5
Molecular Weight 408.4471
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CDC-801

SMILES

COC1=CC=C(C=C1OC2CCCC2)C(CC(N)=O)N3C(=O)C4=C(C=CC=C4)C3=O

InChI

InChIKey=DDYUBCCTNHWSQM-UHFFFAOYSA-N
InChI=1S/C23H24N2O5/c1-29-19-11-10-14(12-20(19)30-15-6-2-3-7-15)18(13-21(24)26)25-22(27)16-8-4-5-9-17(16)23(25)28/h4-5,8-12,15,18H,2-3,6-7,13H2,1H3,(H2,24,26)

HIDE SMILES / InChI

Approval Year

Name Type Language
CDC-801
Code English
CDC801
Code English
CC-1088
Code English
Classification Tree Code System Code
NCI_THESAURUS C744
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
Code System Code Type Description
CAS
467421-06-3
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
NO STRUCTURE GIVEN
NCI_THESAURUS
C2210
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
PRIMARY NCIT
DRUG BANK
DB15640
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID80963649
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
PRIMARY
PUBCHEM
9844338
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
PRIMARY
CAS
192819-27-5
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
PRIMARY
FDA UNII
95HB56U8P8
Created by admin on Fri Dec 15 15:38:55 GMT 2023 , Edited by admin on Fri Dec 15 15:38:55 GMT 2023
PRIMARY