CALCIUM PANTOTHENATE, (±)-

Details

Stereochemistry	RACEMIC
Molecular Formula	2C9H16NO5.Ca
Molecular Weight	476.532
Optical Activity	( + / - )
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Ca++].CC(C)(CO)C(O)C(=O)NCCC([O-])=O.CC(C)(CO)C(O)C(=O)NCCC([O-])=O

InChI

InChIKey=FAPWYRCQGJNNSJ-UHFFFAOYSA-L

InChI=1S/2C9H17NO5.Ca/c2*1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;/h2*7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);/q;;+2/p-2

HIDE SMILES / InChI

Molecular Formula	Ca
Molecular Weight	40.078
Charge	2
Count

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

Molecular Formula	C9H16NO5
Molecular Weight	218.227
Charge	-1
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 17:03:50 GMT 2023` Edited by `admin` on `Fri Dec 15 17:03:50 GMT 2023`
Record UNII	2KC899R47Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CALCIUM PANTOTHENATE, (±)-

Systematic Name

English

CALCIUM PANTOTHENATE, RACEMIC [USP IMPURITY]

Common Name

English

.BETA.-ALANINE, N-(2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)-, CALCIUM SALT (2:1), (±)-

Common Name

English

CALCIUM DL-PANTOTHENATE (1:2)

Systematic Name

English

CALCIUM PANTOTHENATE,RACEMIC

Common Name

English

CALCIUM PANTOTHENATE,RACEMIC [VANDF]

Common Name

English

CALCIUM DL-PANTOTHENATE

Systematic Name

English

CALCIUM (1)-N-(2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)-BETA-ALANINATE

Common Name

English

.BETA.-ALANINE, N-(2,4-DIHYDROXY-3,3-DIMETHYL-1-OXOBUTYL)-, CALCIUM SALT (2:1)

Common Name

English

CALCIUM PANTOTHENATE, RACEMIC

Common Name

English

CALCIUM PANTOTHENATE, RACEMIC [FCC]

Common Name

English

Code System Code Type Description

PUBCHEM

2529