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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H20N2O
Molecular Weight 244.3321
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CYCLOPENTA(4,5)PYRIDO(3,2,1-JK)(1,4)BENZODIAZEPIN-12A(9H)-OL, 4,5,6,7,9A,10,11,12-OCTAHYDRO-, (9AS,12AR)-

SMILES

[H][C@@]12CCC[C@]1(O)C3=C4N(C2)CCNCC4=CC=C3

InChI

InChIKey=RYABTNCLHSGGGV-SWLSCSKDSA-N
InChI=1S/C15H20N2O/c18-15-6-2-4-12(15)10-17-8-7-16-9-11-3-1-5-13(15)14(11)17/h1,3,5,12,16,18H,2,4,6-10H2/t12-,15+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H20N2O
Molecular Weight 244.3321
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:54:56 UTC 2023
Edited
by admin
on Sat Dec 16 15:54:56 UTC 2023
Record UNII
3UE71NM99A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYCLOPENTA(4,5)PYRIDO(3,2,1-JK)(1,4)BENZODIAZEPIN-12A(9H)-OL, 4,5,6,7,9A,10,11,12-OCTAHYDRO-, (9AS,12AR)-
Systematic Name English
VABICASERIN METABOLITE P4
Common Name English
Code System Code Type Description
CAS
2304452-55-7
Created by admin on Sat Dec 16 15:54:56 UTC 2023 , Edited by admin on Sat Dec 16 15:54:56 UTC 2023
PRIMARY
FDA UNII
3UE71NM99A
Created by admin on Sat Dec 16 15:54:56 UTC 2023 , Edited by admin on Sat Dec 16 15:54:56 UTC 2023
PRIMARY
PUBCHEM
154572823
Created by admin on Sat Dec 16 15:54:56 UTC 2023 , Edited by admin on Sat Dec 16 15:54:56 UTC 2023
PRIMARY
Related Record Type Details
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