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Substance Name: Benzoic acid, 2-(acetyloxy)-, 2-(3,4-dihydroxyphenyl)-3,4-dihydro-5,7-dihydroxy-2H-1-benzopyran-3-yl ester, (2R-trans)-
RN: 80500-87-4
InChIKey: OHKUCGXWBFPANI-XZOQPEGZSA-N

Molecular Formula

  • C24-H20-O9

Molecular Weight

  • 452.413
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 80500-87-4

System Generated Number

  • 0080500874

Structure Descriptors

InChI

1S/C24H20O9/c1-12(25)31-20-5-3-2-4-15(20)24(30)33-22-11-16-18(28)9-14(26)10-21(16)32-23(22)13-6-7-17(27)19(29)8-13/h2-10,22-23,26-29H,11H2,1H3/t22-,23+/m0/s1

InChIKey

OHKUCGXWBFPANI-XZOQPEGZSA-N

Smiles

C(c1c(cccc1)OC(=O)C)(=O)O[C@@H]1[C@H](Oc2c(C1)c(cc(c2)O)O)c1cc(c(cc1)O)O