3-Hydroxy-7-methoxy-1,9-dimethyl-8-(3-methyl-1-oxo-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde

CAS Registry Number®

1179374-64-1

CAS Name

3-Hydroxy-7-methoxy-1,9-dimethyl-8-(3-methyl-1-oxo-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde

Molecular Formula

C22H20O7

Molecular Mass

396.39

Cite this Page

3-Hydroxy-7-methoxy-1,9-dimethyl-8-(3-methyl-1-oxo-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1179374-64-1 (retrieved 2024-09-28) (CAS RN: 1179374-64-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    215-219 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C22H20O7/c1-10(2)6-15(25)19-12(4)20-17(8-16(19)27-5)28-21-13(9-23)14(24)7-11(3)18(21)22(26)29-20/h6-9,24H,1-5H3

InChIKey

InChIKey=SEGGMMXRZJRNCN-UHFFFAOYSA-N

SMILES

C(=O)C1=C2C(C(=O)OC=3C(O2)=CC(OC)=C(C(C=C(C)C)=O)C3C)=C(C)C=C1O

Canonical SMILES

O=CC1=C(O)C=C(C=2C(=O)OC3=C(OC12)C=C(OC)C(C(=O)C=C(C)C)=C3C)C

Other Names for this Substance

  • 11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 3-hydroxy-7-methoxy-1,9-dimethyl-8-(3-methyl-1-oxo-2-buten-1-yl)-11-oxo-
  • 3-Hydroxy-7-methoxy-1,9-dimethyl-8-(3-methyl-1-oxo-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde
  • Mollicellin L

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox