U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H27NO2
Molecular Weight 289.4125
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Acoltremon

SMILES

COC1=CC=C(NC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)C=C1

InChI

InChIKey=HNSGVPAAXJJOPQ-XOKHGSTOSA-N
InChI=1S/C18H27NO2/c1-12(2)16-10-5-13(3)11-17(16)18(20)19-14-6-8-15(21-4)9-7-14/h6-9,12-13,16-17H,5,10-11H2,1-4H3,(H,19,20)/t13-,16+,17-/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H27NO2
Molecular Weight 289.4125
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:30:08 UTC 2023
Edited
by admin
on Sat Dec 16 14:30:08 UTC 2023
Record UNII
1L7BVT4Z4Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Acoltremon
USAN   INN  
Official Name English
(1R,2S,5R)-N-(4-Methoxyphenyl)-5-methyl-2-(1-methylethyl)cyclohexanecarboxamide
Systematic Name English
N-(4-METHOXYPHENYL)-P-MENTHANECARBOXAMIDE
Systematic Name English
FEMA NO. 4681
Code English
Cyclohexanecarboxamide, N-(4-methoxyphenyl)-5-methyl-2-(1-methylethyl)-, [1R-(1α,2β,5α)]-
Systematic Name English
AVX-012
Code English
AR-15512
Code English
acoltremon [INN]
Common Name English
WS-12
Code English
[1R,2S,5R]-N-(4-Methoxyphenyl)-p-menthanecarboxamide
Systematic Name English
Cyclohexanecarboxamide, N-(4-methoxyphenyl)-5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-
Systematic Name English
(1R,2S,5R)-N-(4-methoxyphenyl)-5-methyl-2-(propan-2-yl)cyclohexane-1-carboxamide
Systematic Name English
Code System Code Type Description
CAS
57233-03-1
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
SMS_ID
300000045594
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
JECFA MONOGRAPH
2079
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
JECFA MONOGRAPH
2056
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
USAN
LM-158
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
CAS
847565-93-9
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
INN
12127
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
NCI_THESAURUS
C189962
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
CAS
1217498-35-5
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
11266244
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID10460636
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
CAS
68489-09-8
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
FDA UNII
1L7BVT4Z4Z
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
WIKIPEDIA
WS-12
Created by admin on Sat Dec 16 14:30:08 UTC 2023 , Edited by admin on Sat Dec 16 14:30:08 UTC 2023
PRIMARY
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