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Details

Stereochemistry EPIMERIC
Molecular Formula C16H21NO3
Molecular Weight 275.3434
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-HYDROXY-RAMELTEON

SMILES

CC([H])(C(=NCC[C@]1([H])CCc2ccc3c(CCO3)c21)O)O

InChI

InChIKey=FGFNIJYHXMJYJN-KFJBMODSSA-N
InChI=1S/C16H21NO3/c1-10(18)16(19)17-8-6-12-3-2-11-4-5-14-13(15(11)12)7-9-20-14/h4-5,10,12,18H,2-3,6-9H2,1H3,(H,17,19)/t10?,12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H21NO3
Molecular Weight 275.3434
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 1 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 13:37:37 UTC 2021
Edited
by admin
on Sat Jun 26 13:37:37 UTC 2021
Record UNII
EYC868P4VY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-HYDROXY-RAMELTEON
Common Name English
RAMELTEON MII METABOLITE
Common Name English
PROPANAMIDE, 2-HYDROXY-N-(2-((8S)-1,6,7,8-TETRAHYDRO-2H-INDENO(5,4-B)FURAN-8-YL)ETHYL)-
Systematic Name English
RAMELTEON (MII)
Common Name English
Code System Code Type Description
PUBCHEM
46783414
Created by admin on Sat Jun 26 13:37:37 UTC 2021 , Edited by admin on Sat Jun 26 13:37:37 UTC 2021
PRIMARY
FDA UNII
EYC868P4VY
Created by admin on Sat Jun 26 13:37:37 UTC 2021 , Edited by admin on Sat Jun 26 13:37:37 UTC 2021
PRIMARY
EPA CompTox
896736-21-3
Created by admin on Sat Jun 26 13:37:37 UTC 2021 , Edited by admin on Sat Jun 26 13:37:37 UTC 2021
PRIMARY
CAS
896736-21-3
Created by admin on Sat Jun 26 13:37:37 UTC 2021 , Edited by admin on Sat Jun 26 13:37:37 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> METABOLITE ACTIVE
major isozyme metabolizes to S-isomer
MAJOR
PLASMA