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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H31NO2
Molecular Weight 353.4977
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALPHACETYLMETHADOL

SMILES

CC[C@@H](OC(C)=O)C(C[C@@H](C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChIKey=XBMIVRRWGCYBTQ-XMSQKQJNSA-N
InChI=1S/C23H31NO2/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18,22H,6,17H2,1-5H3/t18-,22-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H31NO2
Molecular Weight 353.4977
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 Fri Dec 15 15:28:59 UTC 2023
Edited
by admin
on Fri Dec 15 15:28:59 UTC 2023
Record UNII
BXF83S0HEL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALPHACETYLMETHADOL
INN  
INN  
Official Name English
alphacetylmethadol [INN]
Common Name English
IDS-NA-008
Code English
.ALPHA.-D-ACETYLMETHADOL
Common Name English
.ALPHA.-3-ACETOXY-6-DIMETHYLAMINO-4,4-DIPHENYLHEPTANE
Systematic Name English
(3R,6R)-3-ACETOXY-6-DIMETHYLAMINO-4,4-DIPHENYLHEPTANE
Systematic Name English
ACSCN-9603
Code English
Classification Tree Code System Code
DEA NO. 9603
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
NCI_THESAURUS C241
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
Code System Code Type Description
DRUG BANK
DB01555
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
FDA UNII
BXF83S0HEL
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
NCI_THESAURUS
C72134
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
EVMPD
SUB05363MIG
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
SMS_ID
100000087449
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
EPA CompTox
DTXSID70169198
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
INN
351
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
CAS
17199-58-5
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
PUBCHEM
22308
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
ChEMBL
CHEMBL2107793
Created by admin on Fri Dec 15 15:28:59 UTC 2023 , Edited by admin on Fri Dec 15 15:28:59 UTC 2023
PRIMARY
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