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

Details

Stereochemistry EPIMERIC
Molecular Formula C15H15N3O2
Molecular Weight 269.2985
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6,7,9,10-Tetrahydro-α-hydroxy-6,10-methano-8H-pyrazino[2,3-h][3]benzazepine-8-acetaldehyde

SMILES

OC(C=O)N1C[C@@H]2C[C@H](C1)C3=CC4=NC=CN=C4C=C23

InChI

InChIKey=JSGLUGRYJGRRRV-WYPFBEBGSA-N
InChI=1S/C15H15N3O2/c19-8-15(20)18-6-9-3-10(7-18)12-5-14-13(4-11(9)12)16-1-2-17-14/h1-2,4-5,8-10,15,20H,3,6-7H2/t9-,10+,15?

HIDE SMILES / InChI

Molecular Formula C15H15N3O2
Molecular Weight 269.2985
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 2 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:33:20 GMT 2023
Edited
by admin
on Sat Dec 16 19:33:20 GMT 2023
Record UNII
5C87YDB2QA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6,7,9,10-Tetrahydro-α-hydroxy-6,10-methano-8H-pyrazino[2,3-h][3]benzazepine-8-acetaldehyde
Systematic Name English
6,10-Methano-8H-pyrazino[2,3-h][3]benzazepine-8-acetaldehyde, 6,7,9,10-tetrahydro-α-hydroxy-
Systematic Name English
Code System Code Type Description
PUBCHEM
166451459
Created by admin on Sat Dec 16 19:33:20 GMT 2023 , Edited by admin on Sat Dec 16 19:33:20 GMT 2023
PRIMARY
FDA UNII
5C87YDB2QA
Created by admin on Sat Dec 16 19:33:20 GMT 2023 , Edited by admin on Sat Dec 16 19:33:20 GMT 2023
PRIMARY
CAS
2306217-13-8
Created by admin on Sat Dec 16 19:33:20 GMT 2023 , Edited by admin on Sat Dec 16 19:33:20 GMT 2023
PRIMARY