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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16N2O.C2H2O4
Molecular Weight 294.3031
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BUFOTENINE MONOOXALATE

SMILES

OC(=O)C(O)=O.CN(C)CCC1=CNC2=C1C=C(O)C=C2

InChI

InChIKey=DYESHNNFAFXIKV-UHFFFAOYSA-N
InChI=1S/C12H16N2O.C2H2O4/c1-14(2)6-5-9-8-13-12-4-3-10(15)7-11(9)12;3-1(4)2(5)6/h3-4,7-8,13,15H,5-6H2,1-2H3;(H,3,4)(H,5,6)

HIDE SMILES / InChI

Molecular Formula C12H16N2O
Molecular Weight 204.2682
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H2O4
Molecular Weight 90.0349
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:47:20 UTC 2023
Edited
by admin
on Fri Dec 15 15:47:20 UTC 2023
Record UNII
4494BFP9LU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BUFOTENINE MONOOXALATE
Common Name English
BUFOTENINE HYDROGEN OXALATE
Common Name English
N,N-DIMETHYL-5-HYDROXYTRYPTAMINE MONOOXALATE
Systematic Name English
NSC-95093
Code English
INDOL-5-OL, 3-(2-(DIMETHYLAMINO)ETHYL)-, OXALATE (1:1) (SALT)
Systematic Name English
BUFOTENINE OXALATE (1:1)
Common Name English
Code System Code Type Description
FDA UNII
4494BFP9LU
Created by admin on Fri Dec 15 15:47:20 UTC 2023 , Edited by admin on Fri Dec 15 15:47:20 UTC 2023
PRIMARY
NSC
95093
Created by admin on Fri Dec 15 15:47:20 UTC 2023 , Edited by admin on Fri Dec 15 15:47:20 UTC 2023
PRIMARY
PUBCHEM
18078
Created by admin on Fri Dec 15 15:47:20 UTC 2023 , Edited by admin on Fri Dec 15 15:47:20 UTC 2023
PRIMARY
CAS
2963-79-3
Created by admin on Fri Dec 15 15:47:20 UTC 2023 , Edited by admin on Fri Dec 15 15:47:20 UTC 2023
PRIMARY
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PARENT -> SALT/SOLVATE
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ACTIVE MOIETY