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

Details

Stereochemistry MIXED
Molecular Formula C18H27NO6
Molecular Weight 353.4101
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIXOLANE

SMILES

COC1=CC(=CC(OC)=C1OC)C2(C)OCC(CN3CCOCC3)O2

InChI

InChIKey=ZIOBPMQEBOCFLH-UHFFFAOYSA-N
InChI=1S/C18H27NO6/c1-18(13-9-15(20-2)17(22-4)16(10-13)21-3)24-12-14(25-18)11-19-5-7-23-8-6-19/h9-10,14H,5-8,11-12H2,1-4H3

HIDE SMILES / InChI
Name Type Language
TRIXOLANE
INN  
INN  
Official Name English
trixolane [INN]
Common Name English
4-((2-METHYL-2-(3,4,5-TRIMETHOXYPHENYL)-1,3-DIOXOLAN-4-YL)METHYL)MORPHOLINE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29707
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
NCI_THESAURUS C29698
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
Code System Code Type Description
ChEMBL
CHEMBL2105597
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
NCI_THESAURUS
C152753
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
FDA UNII
FCC8KA23AK
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
CAS
47420-28-0
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
PUBCHEM
3047750
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
EVMPD
SUB11327MIG
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
SMS_ID
100000076953
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
EPA CompTox
DTXSID70866130
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY
INN
3485
Created by admin on Sat Dec 16 15:17:59 GMT 2023 , Edited by admin on Sat Dec 16 15:17:59 GMT 2023
PRIMARY