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N-[(R)-pantothenoyl]-L-cysteine

Properties

Image

Occurences in reactions

MNX_ID

MNXM3059

	#reac
in my sandbox	0
in MNXref (generic)	3
in models (compartimentalized)	4

formula

C₁₂H₂₁N₂O₆S

charge

-1

mass

321.11258

reference

InChIKey

QSYCTARXWYLMOF-CBAPKCEASA-M

InChI

InChI=1S/C12H22N2O6S/c1-12(2,6-15)9(17)10(18)13-4-3-8(16)14-7(5-21)11(19)20/h7,9,15,17,21H,3-6H2,1-2H3,(H,13,18)(H,14,16)(H,19,20)/p-1/t7-,9-/m0/s1

SMILES

CC(C)(CO)[C@@H](O)C(=O)NCCC(=O)N[C@@H](CS)C(=O)[O-]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58480 chebi:58480	N-[(R)-pantothenoyl]-L-cysteine N-[(R)-pantothenoyl]-L-cysteinate N-{N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanyl}-L-cysteinate
hmdb:HMDB0006834	D-Pantothenoyl-L-cysteine (2R)-2-{3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanamido}-3-sulfanylpropanoic acid N-((R)-Pantothenoyl)-L-cysteine N-Pantothenoylcystein N-Pantothenoylcysteine
seed.compound:cpd24515 seedM:cpd24515	D-Pantothenoyl-L-cysteine D-pantothenoyl-L-cysteine N-((R)-Pantothenoyl)-L-cysteine N-Pantothenoylcysteine N-[(R)-pantothenoyl]-L-cysteine N-pantothenoylcysteine
kegg.compound:C04079 keggC:C04079	N-((R)-Pantothenoyl)-L-cysteine D-Pantothenoyl-L-cysteine N-Pantothenoylcysteine
bigg.metabolite:ptcys biggM:ptcys	N-Pantothenoylcysteine
seed.compound:cpd02524 seedM:cpd02524	N-Pantothenoylcysteine D-Pantothenoyl-L-cysteine N-((R)-Pantothenoyl)-L-cysteine N-pantothenoyl-cysteine ptcys
bigg.metabolite:HC01231 biggM:HC01231	N-[(R)-pantothenoyl]-L-cysteinate
CHEBI:18416 chebi:18416	N-[(R)-pantothenoyl]-L-cysteine D-Pantothenoyl-L-cysteine N-((R)-Pantothenoyl)-L-cysteine N-{N-[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]-beta-alanyl}-L-cysteine
metacyc.compound:CPD-46 metacycM:CPD-46	N-[(R)-pantothenoyl]-L-cysteine D-pantothenoyl-L-cysteine N-pantothenoyl-cysteine N-pantothenoylcysteine
hmdb:HMDB06834 chebi:12439 chebi:21462 chebi:21463 chebi:7081 biggM:M_HC01231 biggM:M_ptcys keggC:M_C04079 seedM:M_cpd02524 seedM:M_cpd24515	secondary/obsolete/fantasy identifier