Zeylenone

CAS Registry Number®

193410-84-3

CAS Name

Zeylenone

Molecular Formula

C21H18O7

Molecular Mass

382.36

Cite this Page

Zeylenone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=193410-84-3 (retrieved 2024-11-24) (CAS RN: 193410-84-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    150-152 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H18O7/c22-17-12-11-16(28-20(25)15-9-5-2-6-10-15)18(23)21(17,26)13-27-19(24)14-7-3-1-4-8-14/h1-12,16,18,23,26H,13H2/t16-,18+,21-/m1/s1

InChIKey

InChIKey=UUNZIGRBVXAOSR-PLMTUMEDSA-N

SMILES

C(OC(=O)C1=CC=CC=C1)[C@]2(O)[C@@H](O)[C@H](OC(=O)C3=CC=CC=C3)C=CC2=O

Canonical SMILES

O=C(OCC1(O)C(=O)C=CC(OC(=O)C=2C=CC=CC2)C1O)C=3C=CC=CC3

Other Names for this Substance

  • 2-Cyclohexen-1-one, 4-(benzoyloxy)-6-[(benzoyloxy)methyl]-5,6-dihydroxy-, (4R,5S,6S)-
  • 2-Cyclohexen-1-one, 4-(benzoyloxy)-6-[(benzoyloxy)methyl]-5,6-dihydroxy-, [4R-(4α,5β,6β)]-
  • (4R,5S,6S)-4-(Benzoyloxy)-6-[(benzoyloxy)methyl]-5,6-dihydroxy-2-cyclohexen-1-one
  • Zeylenone
  • Tonkinenin A

View All

Deleted or Replaced CAS Registry Numbers

182219-68-7

CAS INSIGHTSTM
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