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Substance Name: Glyceollin III
RN: 61080-23-7
UNII: 629FG6XLLL
InChIKey: MIYTVBARXCVVHZ-RYGJVYDSSA-N

Note

  • Cholesterol-lowering soy-derived glyceollin.

Molecular Formula

  • C20-H18-O5

Molecular Weight

  • 338.3572
 
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Names and Synonyms

Name of Substance

  • Glyceollin III

Synonyms

  • Glyceollin III
  • UNII-629FG6XLLL

Systematic Name

  • 6H-Benzofuro(3,2-c)furo(3,2-g)(1)benzopyran-6a,9(11aH)-diol, 1,2-dihydro-2-(1-methylethenyl)-, (2S-(2alpha,6aalpha,11aalpha))-

Registry Numbers

CAS Registry Number

  • 61080-23-7

FDA UNII

  • 629FG6XLLL

System Generated Number

  • 0061080237

Structure Descriptors

InChI

InChI=1S/C20H18O5/c1-10(2)15-6-11-5-13-17(8-16(11)24-15)23-9-20(22)14-4-3-12(21)7-18(14)25-19(13)20/h3-5,7-8,15,19,21-22H,1,6,9H2,2H3/t15-,19-,20+/m0/s1

InChIKey

MIYTVBARXCVVHZ-RYGJVYDSSA-N

Smiles

CC(=C)[C@@H]1Cc2cc3[C@@H]4Oc5cc(O)ccc5[C@]4(O)COc3cc2O1