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(R)-pantothenate

Properties

Image

Occurences in reactions

MNX_ID

MNXM734864

	#reac
in my sandbox	0
in MNXref (generic)	22
in models (compartimentalized)	21

formula

C₉H₁₆NO₅

charge

-1

mass

218.229

reference

chebi:29032

InChIKey

GHOKWGTUZJEAQD-ZETCQYMHSA-M

InChI

InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/p-1/t7-/m0/s1

SMILES

[CH3:1][C:9]([CH3:2])([CH2:5][OH:11])[C@H:7]([C:8](=[N:10][CH2:4][CH2:3][C:6](=[O:12])[OH:13])[OH:15])[OH:14]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:29032 chebi:29032	(R)-pantothenate (R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alanine, ion(1-) (R)-Pantothenate 3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoate pantothenate
bigg.metabolite:pnto__R biggM:pnto__R	(R)-Pantothenate
vmhM:pnto_R vmhmetabolite:pnto_R	(R)-Pantothenate 3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoic acid
sabiork.compound:5286 sabiorkM:5286	(R)-Pantothenate Pantothenate Pantothenic acid
metacyc.compound:PANTOTHENATE metacycM:PANTOTHENATE	(R)-pantothenate (R)-N-(2,4-dihydroxy-3,3-dimethyl-oxobutyl)-beta-alanine (R)-pantothenic acid D-pantothenic acid vitamin B5
CHEBI:46905 chebi:46905	(R)-pantothenic acid (+)-Pantothenic acid (R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alanine 3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoic acid D(+)-N-(2,4-dihydroxy-3,3-dimethylbutyryl)-beta-alanine D-(+)-pantothenic acid D-pantothenic acid N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanine PANTOTHENOIC ACID Pantothenic acid chick antidermatitis factor vitamin B5
hmdb:HMDB0250782	3-[[(2S)-2,4-Dihydroxy-3,3-dimethylbutanoyl]amino]propanoic acid (+)-Pantothenate (+)-Pantothenic acid (D)-(+)-Pantothenate (D)-(+)-Pantothenic acid (R)-Pantothenate 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoic acid Chick antidermatitis factor D(+)-N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-b-alanine D(+)-N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-beta-alanine D-Pantothenate D-Pantothenic acid DL-Pantothenate N-(2,4-Dihydroxy-3,3-dimethylbutanoyl)-b-alanine N-(2,4-Dihydroxy-3,3-dimethylbutanoyl)-beta-alanine Pantothenate Vitamin b5 delta-Pantothenate delta-Pantothenic acid pantothenic acid
seed.compound:cpd00644 seedM:cpd00644	PAN (R)-N-(2,4-dihydroxy-3,3-dimethyl-oxobutyl)-beta-alanine (R)-Pantothenate (R)-pantothenate (R)-pantothenic acid 3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]propanoate D-pantothenate D-pantothenic acid Pantothenate Pantothenic acid R-Pantothenate Vitamin_B5 beta-alanine, (R)-N-(2,4-dihydroxy-3,3-dimethyl-oxobutyl)- pnto-R vitamin B5
kegg.compound:C00864 keggC:C00864	Pantothenate (R)-Pantothenate Pantothenic acid
kegg.drug:D07413 keggD:D07413	Pantothenic acid (BAN) Pantothen Pharmaselect (TN)
hmdb:HMDB0000210	Pantothenic acid (+)-Pantothenate (+)-Pantothenic acid (+)-pantothenic acid (R)-N-(2,4-Dihydroxy-3,3-dimethyl-1-oxobutyl)-b-alanine (R)-N-(2,4-Dihydroxy-3,3-dimethyl-1-oxobutyl)-beta-alanine (R)-Pantothenate (R)-Pantothenic acid 3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanoic acid Calcium pantothenate Chick antidermatitis factor D(+)-N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-b-alanine D(+)-N-(2,4-Dihydroxy-3,3-dimethylbutyryl)-beta-alanine D-(+)-Pantothenate D-(+)-Pantothenic acid D-Pantothenate D-Pantothenic acid Dexol N-[(2R)-2,4-Dihydroxy-3,3-dimethylbutanoyl]-b-alanine N-[(2R)-2,4-Dihydroxy-3,3-dimethylbutanoyl]-beta-alanine PANTOTHENOIC ACID PANTOTHENOate Pantothen pharmaselect Pantothenate Pantothenate, calcium Pantothenate, zinc Vitamin b 5 Vitamin b5 Zinc pantothenate b 5, Vitamin b5, Vitamin
CHEBI:16454 chebi:16454	pantothenate 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoate N-(2,4-dihydroxy-3,3-dimethylbutanoyl)-beta-alaninate
reactome:R-ALL-196820 reactomeM:R-ALL-196820 reactome:R-ALL-199192 reactomeM:R-ALL-199192 CHEBI:7916 chebi:7916	pantothenic acid 3-(2,4-dihydroxy-3,3-dimethylbutanamido)propanoic acid N-(2,4-dihydroxy-3,3-dimethylbutanoyl)-beta-alanine Pantothenic acid
biggM:pnto-R hmdb:HMDB00210 hmdb:HMDB0062717 hmdb:HMDB62717 chebi:11008 chebi:14739 chebi:18700 chebi:18701 chebi:25846 chebi:44679 biggM:M_pnto__R keggC:M_C00864 keggD:M_D07413 seedM:M_cpd00644	secondary/obsolete/fantasy identifier