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Substance Name: Aristoloside
RN: 84014-70-0
InChIKey: GMKHAVDYTAXBIY-BSTKLLGTSA-N

Note

  • Extracted from Guan-mu-tong (Caulis aristolochiae manshuriensis); induced the inhibition of preneoplastic mammary gland growth.

Molecular Formula

  • C23-H21-N-O13

Molecular Weight

  • 519.413
 
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Names and Synonyms

Name of Substance

  • Aristoloside

Systematic Name

  • Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid, 10-(beta-D-glucopyranosyloxy)-8-methoxy-6-nitro-

Registry Numbers

CAS Registry Number

  • 84014-70-0

System Generated Number

  • 0084014700

Structure Descriptors

InChI

1S/C23H21NO13/c1-33-13-3-8(36-23-20(28)19(27)18(26)15(6-25)37-23)2-10-9(13)4-12(24(31)32)16-11(22(29)30)5-14-21(17(10)16)35-7-34-14/h2-5,15,18-20,23,25-28H,6-7H2,1H3,(H,29,30)/t15-,18-,19+,20-,23-/m1/s1

InChIKey

GMKHAVDYTAXBIY-BSTKLLGTSA-N

Smiles

O1COc2c1c1c3cc(cc(c3cc(c1c(c2)C(=O)O)[N+](=O)[O-])OC)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO