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Details

Stereochemistry RACEMIC
Molecular Formula C23H18O2
Molecular Weight 326.3878
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-ACETOXY-3-METHYLCHOLANTHRENE

SMILES

CC(=O)OC1CC2=C3C=CC4=CC=CC=C4C3=CC5=C2C1=C(C)C=C5

InChI

InChIKey=DTDNHCYJVIUBGT-UHFFFAOYSA-N
InChI=1S/C23H18O2/c1-13-7-8-16-11-19-17-6-4-3-5-15(17)9-10-18(19)20-12-21(25-14(2)24)22(13)23(16)20/h3-11,21H,12H2,1-2H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
2-ACETOXY-3-METHYLCHOLANTHRENE
Systematic Name English
BENZ(J)ACEANTHRYLEN-2-OL, 1,2-DIHYDRO-3-METHYL-, ACETATE
Systematic Name English
2-CHOLANTHRENOL, 3-METHYL-, ACETATE
Systematic Name English
Code System Code Type Description
CAS
7390-93-4
Created by admin on Sat Dec 16 11:31:10 GMT 2023 , Edited by admin on Sat Dec 16 11:31:10 GMT 2023
PRIMARY
PUBCHEM
146040
Created by admin on Sat Dec 16 11:31:10 GMT 2023 , Edited by admin on Sat Dec 16 11:31:10 GMT 2023
PRIMARY
FDA UNII
8T2174G8AD
Created by admin on Sat Dec 16 11:31:10 GMT 2023 , Edited by admin on Sat Dec 16 11:31:10 GMT 2023
PRIMARY
EPA CompTox
DTXSID80995041
Created by admin on Sat Dec 16 11:31:10 GMT 2023 , Edited by admin on Sat Dec 16 11:31:10 GMT 2023
PRIMARY
NIH
NCATS
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