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Substance Name: 2,3-(Di-glutathion-S-yl)-1,4-naphthoquinone
RN: 107432-96-2
InChIKey: PYPHCUPQHPLOPW-RMYXUZSKSA-N

Molecular Formula

  • C30-H36-N6-O14-S2

Molecular Weight

  • 768.774
 
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Names and Synonyms

Name of Substance

  • 2,3-(Di-glutathion-S-yl)-1,4-naphthoquinone

Synonym

  • Dgsynq

Systematic Name

  • Glycine, 2,2'-(1,4-dihydro-1,4-dioxo-2,3-naphthalenediyl)bis(L-gamma-glutamyl-L-cysteinyl-

Registry Numbers

CAS Registry Number

  • 107432-96-2

System Generated Number

  • 0107432962

Structure Descriptors

InChI

1S/C30H36N6O14S2/c31-15(25(45)46)5-7-17(37)35-29(11-51,27(49)33-9-19(39)40)21-22(24(44)14-4-2-1-3-13(14)23(21)43)30(12-52,28(50)34-10-20(41)42)36-18(38)8-6-16(32)26(47)48/h1-4,15-16,51-52H,5-12,31-32H2,(H,33,49)(H,34,50)(H,35,37)(H,36,38)(H,39,40)(H,41,42)(H,45,46)(H,47,48)/t15-,16-,29-,30-/m0/s1

InChIKey

PYPHCUPQHPLOPW-RMYXUZSKSA-N

Smiles

C1(C(=C(C(c2ccccc12)=O)[C@](NC(CC[C@H](N)C(=O)O)=O)(C(=O)NCC(=O)O)CS)[C@](NC(CC[C@H](N)C(=O)O)=O)(C(=O)NCC(=O)O)CS)=O