(Acetato-O)(palmitato-O)calcium

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H34CaO4
Molecular Weight	354.538
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (Acetato-O)(palmitato-O)calcium

Structure Search

SMILES

CCCCCCCCCCCCCCCC(=O)O[Ca]OC(C)=O

InChI

InChIKey=ATHPTXQOIDOMTL-UHFFFAOYSA-L

InChI=1S/C16H32O2.C2H4O2.Ca/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18;1-2(3)4;/h2-15H2,1H3,(H,17,18);1H3,(H,3,4);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	C18H34CaO4
Molecular Weight	354.538
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:14:38 GMT 2025` Edited by `admin` on `Tue Apr 01 19:14:38 GMT 2025`
Record UNII	AJM9X4M2MZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Calcium, (acetato-O)(hexadecanoato-O)-

Preferred Name

English

(Acetato-O)(palmitato-O)calcium

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID40241450

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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FDA UNII

AJM9X4M2MZ

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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ECHA (EC/EINECS)

305-240-2

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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PUBCHEM

71301405

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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CAS

94386-18-2

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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