COLTEROL ACETATE

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H19NO3.C2H4O2
Molecular Weight	285.3361
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(O)=O.CC(C)(C)NCC(O)C1=CC=C(O)C(O)=C1

InChI

InChIKey=SVYBIDRTCKRNFA-UHFFFAOYSA-N

InChI=1S/C12H19NO3.C2H4O2/c1-12(2,3)13-7-11(16)8-4-5-9(14)10(15)6-8;1-2(3)4/h4-6,11,13-16H,7H2,1-3H3;1H3,(H,3,4)

HIDE SMILES / InChI

Molecular Formula	C2H4O2
Molecular Weight	60.052
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C12H19NO3
Molecular Weight	225.2842
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:30:27 UTC 2023` Edited by `admin` on `Fri Dec 15 16:30:27 UTC 2023`
Record UNII	CUY1XO9278
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

COLTEROL ACETATE

Common Name

English

1,2-BENZENEDIOL, 4-(2-((1,1-DIMETHYLETHYL)AMINO)-1-HYDROXYETHYL)-, ACETATE (1:1)

Systematic Name

English

Code System Code Type Description

CAS

10255-14-8

Created by admin on Fri Dec 15 16:30:27 UTC 2023 , Edited by admin on Fri Dec 15 16:30:27 UTC 2023

PRIMARY

EPA CompTox

DTXSID50907691

Created by admin on Fri Dec 15 16:30:27 UTC 2023 , Edited by admin on Fri Dec 15 16:30:27 UTC 2023

PRIMARY

FDA UNII

CUY1XO9278

Created by admin on Fri Dec 15 16:30:27 UTC 2023 , Edited by admin on Fri Dec 15 16:30:27 UTC 2023

PRIMARY

PUBCHEM

25103

Created by admin on Fri Dec 15 16:30:27 UTC 2023 , Edited by admin on Fri Dec 15 16:30:27 UTC 2023

PRIMARY

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