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Substance Name: Benzeneacetic acid, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)-
RN: 71627-91-3
InChIKey: KDZJCTWPFIDOQW-JTHBVZDNSA-N

Molecular Formula

  • C23-H20-O7

Molecular Weight

  • 408.404
 
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Names and Synonyms

  • Benzeneacetic acid, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)-

Registry Numbers

CAS Registry Number

  • 71627-91-3

System Generated Number

  • 0071627913

Structure Descriptors

InChI

1S/C23H20O7/c24-15-10-18(26)16-12-21(29-22(28)8-13-4-2-1-3-5-13)23(30-20(16)11-15)14-6-7-17(25)19(27)9-14/h1-7,9-11,21,23-27H,8,12H2/t21-,23+/m0/s1

InChIKey

KDZJCTWPFIDOQW-JTHBVZDNSA-N

Smiles

c1(ccccc1)CC(=O)O[C@@H]1[C@H](Oc2c(C1)c(cc(c2)O)O)c1cc(c(cc1)O)O