Jacareubin

CAS Registry Number®

3811-29-8

CAS Name

Jacareubin

Molecular Formula

C18H14O6

Molecular Mass

326.30

Cite this Page

Jacareubin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3811-29-8 (retrieved 2024-11-24) (CAS RN: 3811-29-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    256-257 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H14O6/c1-18(2)6-5-8-11(24-18)7-12-13(14(8)20)15(21)9-3-4-10(19)16(22)17(9)23-12/h3-7,19-20,22H,1-2H3

InChIKey

InChIKey=UCLUVPCGXYTYEK-UHFFFAOYSA-N

SMILES

O=C1C=2C(=CC3=C(C2O)C=CC(C)(C)O3)OC=4C1=CC=C(O)C4O

Canonical SMILES

O=C1C2=CC=C(O)C(O)=C2OC3=CC=4OC(C=CC4C(O)=C13)(C)C

Other Names for this Substance

  • 2H,6H-Pyrano[3,2-b]xanthen-6-one, 5,9,10-trihydroxy-2,2-dimethyl-
  • 5,9,10-Trihydroxy-2,2-dimethyl-2H,6H-pyrano[3,2-b]xanthen-6-one
  • Jacareubin

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