BITOLTEROL, (S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H31NO5
Molecular Weight	461.5494
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2OC(=O)C3=CC=C(C)C=C3)[C@H](O)CNC(C)(C)C

InChI

InChIKey=FZGVEKPRDOIXJY-HSZRJFAPSA-N

InChI=1S/C28H31NO5/c1-18-6-10-20(11-7-18)26(31)33-24-15-14-22(23(30)17-29-28(3,4)5)16-25(24)34-27(32)21-12-8-19(2)9-13-21/h6-16,23,29-30H,17H2,1-5H3/t23-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H31NO5
Molecular Weight	461.5494
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:31:01 GMT 2025` Edited by `admin` on `Mon Mar 31 23:31:01 GMT 2025`
Record UNII	CN0A76P5YE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

BITOLTEROL, (S)-

Common Name

English

BENZOIC ACID, 4-METHYL-, 1,1'-(4-(2-((1,1-DIMETHYLETHYL)AMINO)-1-HYDROXYETHYL)-1,2-PHENYLENE) ESTER, (S)-

Preferred Name

English

Code System Code Type Description

PUBCHEM

45266841

Created by admin on Mon Mar 31 23:31:01 GMT 2025 , Edited by admin on Mon Mar 31 23:31:01 GMT 2025

PRIMARY

FDA UNII

CN0A76P5YE

Created by admin on Mon Mar 31 23:31:01 GMT 2025 , Edited by admin on Mon Mar 31 23:31:01 GMT 2025

PRIMARY

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