METHYL-PENICILLANATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C9H13NO3S
Molecular Weight	215.269
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)[C@@H]1N2[C@@H](CC2=O)SC1(C)C

InChI

InChIKey=DJANLSNABDFZLA-RQJHMYQMSA-N

InChI=1S/C9H13NO3S/c1-9(2)7(8(12)13-3)10-5(11)4-6(10)14-9/h6-7H,4H2,1-3H3/t6-,7+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C9H13NO3S
Molecular Weight	215.269
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:34:59 GMT 2025` Edited by `admin` on `Tue Apr 01 19:34:59 GMT 2025`
Record UNII	N7HF84OJLU
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

METHYL-PENICILLANATE

Common Name

English

METHYL PENICILLANATE

Preferred Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-7-OXO-, METHYL ESTER, (2S,5R)-

Systematic Name

English

PENICILLANIC ACID METHYL ESTER

Common Name

English

4-THIA-1-AZABICYCLO(3.2.0)HEPTANE-2-CARBOXYLIC ACID, 3,3-DIMETHYL-7-OXO-, METHYL ESTER, (2S-CIS)-

Systematic Name

English

Code System Code Type Description

CAS

4027-61-6

Created by admin on Tue Apr 01 19:34:59 GMT 2025 , Edited by admin on Tue Apr 01 19:34:59 GMT 2025

PRIMARY

FDA UNII

N7HF84OJLU

Created by admin on Tue Apr 01 19:34:59 GMT 2025 , Edited by admin on Tue Apr 01 19:34:59 GMT 2025

PRIMARY

EPA CompTox

DTXSID201133254

Created by admin on Tue Apr 01 19:34:59 GMT 2025 , Edited by admin on Tue Apr 01 19:34:59 GMT 2025

PRIMARY

PUBCHEM

12914554

Created by admin on Tue Apr 01 19:34:59 GMT 2025 , Edited by admin on Tue Apr 01 19:34:59 GMT 2025

PRIMARY