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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H24N2.C7H8O3S
Molecular Weight 452.609
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DALEDALIN TOSYLATE, (R)-

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.CNCCC[C@@]2(C)CN(C3=C2C=CC=C3)C4=CC=CC=C4

InChI

InChIKey=HCIFDIMOPGHYSI-FYZYNONXSA-N
InChI=1S/C19H24N2.C7H8O3S/c1-19(13-8-14-20-2)15-21(16-9-4-3-5-10-16)18-12-7-6-11-17(18)19;1-6-2-4-7(5-3-6)11(8,9)10/h3-7,9-12,20H,8,13-15H2,1-2H3;2-5H,1H3,(H,8,9,10)/t19-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C7H8O3S
Molecular Weight 172.202
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C19H24N2
Molecular Weight 280.4073
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:53:45 GMT 2023
Edited
by admin
on Sat Dec 16 10:53:45 GMT 2023
Record UNII
10AB61JERH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DALEDALIN TOSYLATE, (R)-
Common Name English
1H-INDOLE-3-PROPANAMINE, 2,3-DIHYDRO-N,3-DIMETHYL-1-PHENYL-, 4-METHYLBENZENESULFONATE, (R)-
Systematic Name English
Code System Code Type Description
FDA UNII
10AB61JERH
Created by admin on Sat Dec 16 10:53:45 GMT 2023 , Edited by admin on Sat Dec 16 10:53:45 GMT 2023
PRIMARY
PUBCHEM
76972864
Created by admin on Sat Dec 16 10:53:45 GMT 2023 , Edited by admin on Sat Dec 16 10:53:45 GMT 2023
PRIMARY
Related Record Type Details
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