EcoDrugPlus


Trade Names	CALCIUM GLUCEPTATE
Synonyms	Calcium gluceptate Calcium glucoheptonate Calcium glucoheptonate (1:2) Calcium glucoheptone NSC-755885
Status
Molecule Category	Salt-form
UNII	L11651398J
EPA CompTox	DTXSID30951637
Parent Compound:	CALCIUM

Trade Names

CALCIUM GLUCEPTATE

Synonyms

Calcium gluceptate

Calcium glucoheptonate

Calcium glucoheptonate (1:2)

Calcium glucoheptone

NSC-755885

Status

Molecule Category

Salt-form

UNII

L11651398J

EPA CompTox

DTXSID30951637

Parent Compound:

CALCIUM


InChI Key	FATUQANACHZLRT-KMRXSBRUSA-L
Smiles	O=C([O-])C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C([O-])C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[Ca+2]
InChI	InChI=1S/2C7H14O8.Ca/c28-1-2(9)3(10)4(11)5(12)6(13)7(14)15;/h22-6,8-13H,1H2,(H,14,15);/q;;+2/p-2/t2*2-,3-,4+,5-,6?;/m11./s1

InChI Key

FATUQANACHZLRT-KMRXSBRUSA-L

Smiles

O=C([O-])C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.O=C([O-])C(O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.[Ca+2]

InChI

InChI=1S/2C7H14O8.Ca/c2*8-1-2(9)3(10)4(11)5(12)6(13)7(14)15;/h2*2-6,8-13H,1H2,(H,14,15);/q;;+2/p-2/t2*2-,3-,4+,5-,6?;/m11./s1

Property Name	Value
Molecular Formula	C14H26CaO16
Molecular Weight	490.42

Property Name

Value

Molecular Formula

C14H26CaO16

Molecular Weight

490.42

Resources	Reference
CAS NUMBER	29039-00-7
ChEBI	3314
ChEMBL	CHEMBL1237066
DrugBank	DB00326
FDA SRS	L11651398J
PharmGKB	PA164746233

Resources

Reference

CAS NUMBER

ChEBI

ChEMBL

DrugBank

FDA SRS

PharmGKB

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, Volume 54, Issue D1, 6 January 2026, Pages D1397–D1404, https://doi.org/10.1093/nar/gkaf1251

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

Last update: Monday, 23^rd March 2026

CALCIUM GLUCEPTATE

Structure

Physicochemical Descriptors

Cross References