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S-(1,4-dihydroxy-3-methylnaphthalen-2-yl)glutathione(1-)

Properties

Image

Occurences in reactions

MNX_ID

MNXM105461

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

formula

C₂₁H₂₄N₃O₈S

charge

-1

mass

478.12896

reference

chebi:133881

InChIKey

AELCICNFWFTRPE-KBPBESRZSA-M

InChI

InChI=1S/C21H25N3O8S/c1-10-17(28)11-4-2-3-5-12(11)18(29)19(10)33-9-14(20(30)23-8-16(26)27)24-15(25)7-6-13(22)21(31)32/h2-5,13-14,28-29H,6-9,22H2,1H3,(H,23,30)(H,24,25)(H,26,27)(H,31,32)/p-1/t13-,14-/m0/s1

SMILES

Cc1c(SC[C@H](NC(=O)CC[C@H]([NH3+])C(=O)[O-])C(=O)NCC(=O)[O-])c(O)c2ccccc2c1O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:133881 chebi:133881	S-(1,4-dihydroxy-3-methylnaphthalen-2-yl)glutathione(1-) (2S)-2-azaniumyl-5-({(2R)-1-[(carboxylatomethyl)amino]-3-[(1,4-dihydroxy-3-methylnaphthalen-2-yl)sulfanyl]-1-oxopropan-2-yl}amino)-5-oxopentanoate menadiolglutathione(1)
metacyc.compound:CPD0-2515 metacycM:CPD0-2515	3-(glutathion-S-yl)-2-methyl-1,4-naphthohydroquinone GS-menadiol
CHEBI:136423 chebi:136423	S-(1,4-dihydroxy-3-methylnaphthalen-2-yl)glutathione 2-Methyl-3-glutathionyl-1,4-naphthoquinone 2-methyl-3-(glutathion-S-yl)-1,4-naphthoquinone L-gamma-glutamyl-S-(1,4-dihydroxy-3-methylnaphthalen-2-yl)-L-cysteinylglycine M-Gssg-NQ menadiolglutathione