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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H23NO4
Molecular Weight 377.433
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phenyl[(4aS,6R,8aS)-4a,5,9,10-tetrahydro-6-hydroxy-3-methoxy-6H-benzofuro[3a,3,2-ef][2]benzazepin-11(12H)-yl]methanone

SMILES

COC1=C2O[C@H]3C[C@@H](O)C=C[C@]34CCN(CC(C=C1)=C24)C(=O)C5=CC=CC=C5

InChI

InChIKey=FWWZVTDISJWUDM-LTMIRXACSA-N
InChI=1S/C23H23NO4/c1-27-18-8-7-16-14-24(22(26)15-5-3-2-4-6-15)12-11-23-10-9-17(25)13-19(23)28-21(18)20(16)23/h2-10,17,19,25H,11-14H2,1H3/t17-,19-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H23NO4
Molecular Weight 377.433
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:48:36 GMT 2025
Edited
by admin
on Wed Apr 02 19:48:36 GMT 2025
Record UNII
BT484QS3MR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(1S,12S,14R)-4-Benzoyl-9-methoxy-11-oxa-4-azatetracyclo[8.6.1.0^{1,12}.0^{6,17}]heptadeca-6,8,10(17),15-tetraen-14-ol
Preferred Name English
Phenyl[(4aS,6R,8aS)-4a,5,9,10-tetrahydro-6-hydroxy-3-methoxy-6H-benzofuro[3a,3,2-ef][2]benzazepin-11(12H)-yl]methanone
Systematic Name English
Methanone, phenyl[(4aS,6R,8aS)-4a,5,9,10-tetrahydro-6-hydroxy-3-methoxy-6H-benzofuro[3a,3,2-ef][2]benzazepin-11(12H)-yl]-
Systematic Name English
Code System Code Type Description
FDA UNII
BT484QS3MR
Created by admin on Wed Apr 02 19:48:36 GMT 2025 , Edited by admin on Wed Apr 02 19:48:36 GMT 2025
PRIMARY
PUBCHEM
58872805
Created by admin on Wed Apr 02 19:48:36 GMT 2025 , Edited by admin on Wed Apr 02 19:48:36 GMT 2025
PRIMARY
CAS
1803179-65-8
Created by admin on Wed Apr 02 19:48:36 GMT 2025 , Edited by admin on Wed Apr 02 19:48:36 GMT 2025
PRIMARY