Chalcomoracin

CAS Registry Number®

76472-89-4
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CAS Name

Chalcomoracin

Molecular Formula

C39H36O9

Molecular Mass

648.70

Cite this Page

Chalcomoracin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=76472-89-4 (retrieved 2024-09-19) (CAS RN: 76472-89-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C39H36O9/c1-19(2)4-8-26-30(42)11-10-27(38(26)46)39(47)36-28(25-9-7-23(40)17-31(25)43)12-20(3)13-29(36)37-32(44)14-22(15-33(37)45)34-16-21-5-6-24(41)18-35(21)48-34/h4-7,9-11,13-18,28-29,36,40-46H,8,12H2,1-3H3/t28-,29+,36-/m1/s1

InChIKey

InChIKey=SEHVRKPXIDOTRX-QQDDVHTNSA-N

SMILES

C(=O)([C@H]1[C@H](C=C(C)C[C@@H]1C2=C(O)C=C(O)C=C2)C3=C(O)C=C(C=C3O)C4=CC=5C(O4)=CC(O)=CC5)C6=C(O)C(CC=C(C)C)=C(O)C=C6

Canonical SMILES

O=C(C1=CC=C(O)C(=C1O)CC=C(C)C)C2C(C=C(C)CC2C3=CC=C(O)C=C3O)C4=C(O)C=C(C=C4O)C=5OC=6C=C(O)C=CC6C5

Other Names for this Substance

  • Methanone, [(1R,2S,6S)-2-[2,6-dihydroxy-4-(6-hydroxy-2-benzofuranyl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methyl-3-cyclohexen-1-yl][2,4-dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]-, (+)-
  • Methanone, [2-[2,6-dihydroxy-4-(6-hydroxy-2-benzofuranyl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methyl-3-cyclohexen-1-yl][2,4-dihydroxy-3-(3-methyl-2-butenyl)phenyl]-, (1α,2α,6β)-(+)-
  • Methanone, [(1R,2S,6S)-2-[2,6-dihydroxy-4-(6-hydroxy-2-benzofuranyl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methyl-3-cyclohexen-1-yl][2,4-dihydroxy-3-(3-methyl-2-butenyl)phenyl]-, (+)-
  • (+)-[(1R,2S,6S)-2-[2,6-Dihydroxy-4-(6-hydroxy-2-benzofuranyl)phenyl]-6-(2,4-dihydroxyphenyl)-4-methyl-3-cyclohexen-1-yl][2,4-dihydroxy-3-(3-methyl-2-buten-1-yl)phenyl]methanone
  • Chalcomoracin

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