HOMATROPINE TEREPHTHALATE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C16H21NO3.C8H6O4
Molecular Weight	441.4737
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)C1=CC=C(C=C1)C(O)=O.CN2[C@H]3CC[C@@H]2C[C@@H](C3)OC(=O)C(O)C4=CC=CC=C4

InChI

InChIKey=GZOBYLKCMLZSCM-RDYJJYPNSA-N

InChI=1S/C16H21NO3.C8H6O4/c1-17-12-7-8-13(17)10-14(9-12)20-16(19)15(18)11-5-3-2-4-6-11;9-7(10)5-1-2-6(4-3-5)8(11)12/h2-6,12-15,18H,7-10H2,1H3;1-4H,(H,9,10)(H,11,12)/t12-,13+,14+,15?;

HIDE SMILES / InChI

Molecular Formula	C8H6O4
Molecular Weight	166.1308
Charge	0
Count

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

Molecular Formula	C16H21NO3
Molecular Weight	275.3428
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:19:54 UTC 2023` Edited by `admin` on `Fri Dec 15 15:19:54 UTC 2023`
Record UNII	UWG9VR2QJC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

HOMATROPINE TEREPHTHALATE

Common Name

English

Homatropine terephthalate [WHO-DD]

Common Name

English

1,4-BENZENEDICARBOXYLIC ACID, COMPD. WITH ENDO-8-METHYL-8-AZABICYCLO(3.2.1)OCT-3-YL .ALPHA.-HYDROXYBENZENEACETATE (1:1)

Common Name

English

Code System Code Type Description

CAS

25442-86-8