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

Details

Stereochemistry EPIMERIC
Molecular Formula C20H31NO2
Molecular Weight 317.4656
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-HYDROXY-DERAMCICLANE

SMILES

[H][C@]12CC[C@](C)(C1(C)C)[C@@](C2)(OC(O)CN(C)C)C3=CC=CC=C3

InChI

InChIKey=AAHVCKGZGMMTPQ-FQVATPOOSA-N
InChI=1S/C20H31NO2/c1-18(2)16-11-12-19(18,3)20(13-16,15-9-7-6-8-10-15)23-17(22)14-21(4)5/h6-10,16-17,22H,11-14H2,1-5H3/t16-,17?,19-,20+/m1/s1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
1-HYDROXY-DERAMCICLANE
Common Name English
ETHANOL, 2-(DIMETHYLAMINO)-1-(((1R,2S,4R)-1,7,7-TRIMETHYL-2-PHENYLBICYCLO(2.2.1)HEPT-2-YL)OXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
154731612
Created by admin on Sat Dec 16 16:12:20 GMT 2023 , Edited by admin on Sat Dec 16 16:12:20 GMT 2023
PRIMARY
CAS
871513-98-3
Created by admin on Sat Dec 16 16:12:20 GMT 2023 , Edited by admin on Sat Dec 16 16:12:20 GMT 2023
PRIMARY
FDA UNII
2Q4BOR7351
Created by admin on Sat Dec 16 16:12:20 GMT 2023 , Edited by admin on Sat Dec 16 16:12:20 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of DERAMCICLANE
NIH
NCATS
PRIVACY ACT
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966