EcoDrugPlus


Synonyms	(5r)-carbapenem Antibiotic tan 458 Carbapenem Carbapenem, (5r)- SQ-27860
Status
Molecule Category	Free-form
UNII	GL970841YS

Synonyms

(5r)-carbapenem

Antibiotic tan 458

Carbapenem

Carbapenem, (5r)-

SQ-27860

Status

Molecule Category

Free-form

UNII

GL970841YS


InChI Key	BSIMZHVOQZIAOY-SCSAIBSYSA-N
Smiles	O=C(O)C1=CC[C@@H]2CC(=O)N12
InChI	InChI=1S/C7H7NO3/c9-6-3-4-1-2-5(7(10)11)8(4)6/h2,4H,1,3H2,(H,10,11)/t4-/m1/s1

InChI Key

BSIMZHVOQZIAOY-SCSAIBSYSA-N

Smiles

O=C(O)C1=CC[C@@H]2CC(=O)N12

InChI

InChI=1S/C7H7NO3/c9-6-3-4-1-2-5(7(10)11)8(4)6/h2,4H,1,3H2,(H,10,11)/t4-/m1/s1

Property Name	Value
Molecular Formula	C7H7NO3
Molecular Weight	153.14
AlogP	-0.04
Hydrogen Bond Acceptor	2.0
Hydrogen Bond Donor	1.0
Number of Rotational Bond	1.0
Polar Surface Area	57.61
Molecular species	ACID
Aromatic Rings	0.0
Heavy Atoms	11.0

Property Name

Value

Molecular Formula

C7H7NO3

Molecular Weight

153.14

AlogP

-0.04

Hydrogen Bond Acceptor

2.0

Hydrogen Bond Donor

1.0

Number of Rotational Bond

1.0

Polar Surface Area

57.61

Molecular species

ACID

Aromatic Rings

0.0

Heavy Atoms

11.0

Resources	Reference
ChEBI	615
ChEMBL	CHEMBL1240705
FDA SRS	GL970841YS
KEGG	C06669
PubChem	441133
SureChEMBL	SCHEMBL8106876

Resources

Reference

ChEBI

ChEMBL

FDA SRS

KEGG

PubChem

SureChEMBL

EcoDrug+ was developed under the PREMIER Innovative Medicines Initiative 2 Joint Undertaking (JU) under grant agreement No 875508. The JU receives support from the EU’s Horizon 2020 research and innovation programme and the European Federation of Pharmaceutical Industries and Associations (EFPIA). The views reflect only the authors’ perspective and the JU is not responsible for any use that may be made of the information EcoDrug+ contains.

Elements of EcoDrug+ were developed under the Biocenter Finland Drug Discovery and Chemical Biology network. CSC-IT Center for Science Ltd is thanked for providing computational resources. Credit is given to Ensembl for collecting species images (provided under public domain licences such as Wikimedia and NHGRI).

Content of EcoDrug+ is provided without guarantee for correctness.

Cite Us:

Ashenafi Legehar, Siobhán Monaghan, Mael Briand, Akseli Niemelä, Leo Ghemtio, Ziaurrehman Tanoli, A Ross Brown, Charles R Tyler, Henri Xhaard, EcoDrug PLUS: an advanced database for drug target conservation analysis and environmental risk assessment, Nucleic Acids Research, 2025, gkaf1251 Read...

This work is licensed under Creative Commons Attribution-ShareAlike 4.0 International License

Last update: Monday, 3 November 2025

CARBAPENEM

Structure

Physicochemical Descriptors

Cross References