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Details

Stereochemistry ACHIRAL
Molecular Formula C23H23NO2
Molecular Weight 345.4342
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CRISNATOL

SMILES

CC(CO)(CO)NCC1=CC2=C(C=CC3=CC=CC=C23)C4=C1C=CC=C4

InChI

InChIKey=SBRXTSOCZITGQG-UHFFFAOYSA-N
InChI=1S/C23H23NO2/c1-23(14-25,15-26)24-13-17-12-22-18-7-3-2-6-16(18)10-11-21(22)20-9-5-4-8-19(17)20/h2-12,24-26H,13-15H2,1H3

HIDE SMILES / InChI

Molecular Formula C23H23NO2
Molecular Weight 345.4342
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 Sat Dec 16 17:25:13 UTC 2023
Edited
by admin
on Sat Dec 16 17:25:13 UTC 2023
Record UNII
2J71UR51UE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CRISNATOL
INN  
INN  
Official Name English
2-((6-CHRYSENYLMETHYL)AMINO)-2-METHYL-1,3-PROPANEDIOL
Systematic Name English
crisnatol [INN]
Common Name English
1,3-PROPANEDIOL, 2-((6-CHRYSENYLMETHYL)AMINO)-2-METHYL-
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C582
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
Code System Code Type Description
PUBCHEM
57062
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
CAS
96389-68-3
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
FDA UNII
2J71UR51UE
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
NCI_THESAURUS
C81191
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
SMS_ID
100000083718
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
ChEMBL
CHEMBL61495
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
MESH
C056722
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
EVMPD
SUB06820MIG
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID10242217
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
WIKIPEDIA
Crisnatol
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
INN
6225
Created by admin on Sat Dec 16 17:25:14 UTC 2023 , Edited by admin on Sat Dec 16 17:25:14 UTC 2023
PRIMARY
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