Fisetinidol-(4α-8)-catechin

CAS Registry Number®

57526-59-7
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CAS Name

Fisetinidol-(4α-8)-catechin

Molecular Formula

C30H26O11

Molecular Mass

562.52

Cite this Page

Fisetinidol-(4α-8)-catechin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57526-59-7 (retrieved 2024-09-19) (CAS RN: 57526-59-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H26O11/c31-14-3-4-15-24(9-14)40-29(13-2-6-18(33)21(36)8-13)27(39)25(15)26-22(37)11-19(34)16-10-23(38)28(41-30(16)26)12-1-5-17(32)20(35)7-12/h1-9,11,23,25,27-29,31-39H,10H2/t23-,25-,27-,28+,29+/m0/s1

InChIKey

InChIKey=CVPALQKJIJFGCD-WXMJOIKDSA-N

SMILES

O[C@H]1[C@@H](C=2C(O[C@@H]1C3=CC(O)=C(O)C=C3)=CC(O)=CC2)C4=C5C(C[C@H](O)[C@H](O5)C6=CC(O)=C(O)C=C6)=C(O)C=C4O

Canonical SMILES

OC1=CC=C2C(OC(C3=CC=C(O)C(O)=C3)C(O)C2C=4C(O)=CC(O)=C5C4OC(C6=CC=C(O)C(O)=C6)C(O)C5)=C1

Other Names for this Substance

  • [4,8′-Bi-2H-1-benzopyran]-3,3′,5′,7,7′-pentol, 2,2′-bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro-, (2R,2′R,3S,3′S,4S)-
  • [4,8′-Bi-2H-1-benzopyran]-3,3′,5′,7,7′-pentol, 2,2′-bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro-, [2R-[2α,3β,4α(2′R*,3′S*)]]-
  • (2R,2′R,3S,3′S,4S)-2,2′-Bis(3,4-dihydroxyphenyl)-3,3′,4,4′-tetrahydro[4,8′-bi-2H-1-benzopyran]-3,3′,5′,7,7′-pentol
  • Fisetinidol-(4α-8)-catechin

Deleted or Replaced CAS Registry Numbers

107493-96-9, 10438-79-6