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Details

Stereochemistry RACEMIC
Molecular Formula C10H18O2
Molecular Weight 170.2487
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SOBREROL, TRANS-, (±)-

SMILES

CC1=CC[C@H](C[C@@H]1O)C(C)(C)O

InChI

InChIKey=OMDMTHRBGUBUCO-BDAKNGLRSA-N
InChI=1S/C10H18O2/c1-7-4-5-8(6-9(7)11)10(2,3)12/h4,8-9,11-12H,5-6H2,1-3H3/t8-,9+/m1/s1

HIDE SMILES / InChI
Molecular Formula C10H18O2
Molecular Weight 170.2487
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Description

trans-Sobrerol is a mucolytic known due its emplyment in therapy for respiratory diseases. In preclinical studies sobrerol, administered daily at the oral dose of 400 mg/rat, markedly decreased the monocrotaline-induced alterations and regulate the development of pulmonary hypertension. Treatment with sobrerol was well tolerated and significantly reduced frontal headache and rhinorrhoea, efficacy being confirmed by rhinomanometry.

Approval Year

Unknown
139594
PubMed

PubMed

TitleDatePubMed
Biotransformation of limonene by Pseudomonas putida.
2001 May
A novel synthesis of oxabicyclo[3.3.1]nonanone via (3,5)-oxonium-ene reaction.
2010 Apr 16
Patents

Patents

20110152496
2
7927613
118
8895691
2
JPH0952854A
2
WO2009105667A2
2
WO2011066616A1
2
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:48:06 GMT 2023
Edited
by admin
on Fri Dec 15 15:48:06 GMT 2023
Record UNII
AI0NX02O35
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SOBREROL, TRANS-, (±)-
Common Name English
(±)-TRANS-5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-3-CYCLOHEXENE-1-METHANOL
Common Name English
SOBREROL [MART.]
Common Name English
(±)-TRANS-SOBREROL
Common Name English
TRANS-6-HYDROXY-.ALPHA.-TERPINEOL
Common Name English
3-CYCLOHEXENE-1-METHANOL, 5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-, (1R,5S)-REL-
Systematic Name English
SOBREROL [MI]
Common Name English
D,L-TRANS-SOBREROL
Common Name English
SOBREROL DL-TRANS-FORM [MI]
Common Name English
6,8-CARVOMENTHENEDIOL, TRANS
Common Name English
SOBREROL
MART.   WHO-DD  
Common Name English
3-CYCLOHEXENE-1-METHANOL, 5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-, TRANS-
Common Name English
DL-TRANS-P-MENTH-6-ENE-2,8-DIOL
Common Name English
LYSMUCOL
Common Name English
SOBREROL, (±)-TRANS-
Common Name English
DL-SOBREROL
Common Name English
Sobrerol [WHO-DD]
Common Name English
SOBREPIN
Common Name English
SOBREROL, DL-TRANS-FORM
Common Name English
TRANS-5-HYDROXY-.ALPHA.,.ALPHA.,4-TRIMETHYL-3-CYCLOHEXENE-1-METHANOL
Systematic Name English
Classification Tree Code System Code
WHO-VATC QR05CB07
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
WHO-ATC R05CB07
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
Code System Code Type Description
PUBCHEM
854498
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
CAS
42370-41-2
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
ECHA (EC/EINECS)
207-868-1
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
ALTERNATIVE
EVMPD
SUB15264MIG
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
ChEMBL
CHEMBL459048
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
DRUG BANK
DB13315
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
RXCUI
36669
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY RxNorm
SMS_ID
100000091778
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
FDA UNII
AI0NX02O35
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
MERCK INDEX
m9975
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY Merck Index
CAS
498-71-5
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
ECHA (EC/EINECS)
255-780-7
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
DRUG CENTRAL
2454
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
EPA CompTox
DTXSID501317156
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
WIKIPEDIA
SOBREROL
Created by admin on Fri Dec 15 15:48:06 GMT 2023 , Edited by admin on Fri Dec 15 15:48:06 GMT 2023
PRIMARY
Related Record Type Details
Structure of SOBREROL, TRANS-(-)-
ENANTIOMER -> RACEMATE
Structure of SOBREROL, TRANS-(+)-
ENANTIOMER -> RACEMATE
Related Record Type Details
Structure of SOBREROL, TRANS-, (±)-
ACTIVE MOIETY
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