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Substance Name: Tri(O-methoxy)magnesium salt of beta-glycyrrhizic acid
RN: 134771-72-5
InChIKey: MHGVDLIOHXBHMM-UHFFFAOYSA-K

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C45-H68-Mg3-O19

Molecular Weight

  • 985.9282
 
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Names and Synonyms

Results Name

  • Tri(O-methoxy)magnesium salt of beta-glycyrrhizic acid

Synonym

  • Tri(O-methoxy)magnesium salt of beta-glycyrrhizic acid

Systematic Name

  • Magnesium, (mu-3-((3-beta,20-beta)-20-carboxy-11-oxo-30-norolean-12-en-3-yl 4-O-beta-D-glucopyranuronosyl-alpha-D-glucopyranosiduronato(3-)))trimethoxytri-

Registry Numbers

CAS Registry Number

  • 134771-72-5

System Generated Number

  • 0134771725

Structure Descriptors

InChI

1S/C42H62O16.3CH3O.3Mg/c1-37(2)15-18(55-34-27(48)25(46)28(30(58-34)33(51)52)56-35-26(47)23(44)24(45)29(57-35)32(49)50)16-40(5)22(37)8-9-42(7)31(40)21(43)14-19-20-17-39(4,36(53)54)11-10-38(20,3)12-13-41(19,42)6;3*1-2;;;/h14,18,20,22-31,34-35,44-48H,8-13,15-17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);3*1H3;;;/q;3*-1;3*+2/p-3

InChIKey

MHGVDLIOHXBHMM-UHFFFAOYSA-K

Smiles

CC1(CC(CC2(C1CCC3(C2C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O[Mg]OC)C)C)C)C)OC6C(C(C(C(O6)C(=O)[O-])OC7C(C(C(C(O7)C(=O)[O-])O)O)O)O)O)C.C[O-].C[O-].[Mg+2].[Mg+2]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 10gm/kg (10000mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 201, 1991.