Cochliodinol

CAS Registry Number®

11051-88-0
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CAS Name

Cochliodinol

Molecular Formula

C32H30N2O4

Molecular Mass

506.59

Cite this Page

Cochliodinol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=11051-88-0 (retrieved 2024-06-25) (CAS RN: 11051-88-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    206-208 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C32H30N2O4/c1-17(2)5-7-19-9-11-25-21(13-19)23(15-33-25)27-29(35)31(37)28(32(38)30(27)36)24-16-34-26-12-10-20(14-22(24)26)8-6-18(3)4/h5-6,9-16,33-35,38H,7-8H2,1-4H3

InChIKey

InChIKey=ZXRULNXZJSCTQQ-UHFFFAOYSA-N

SMILES

O=C1C(=C(O)C(=O)C(=C1O)C=2C=3C(NC2)=CC=C(CC=C(C)C)C3)C=4C=5C(NC4)=CC=C(CC=C(C)C)C5

Canonical SMILES

O=C1C(O)=C(C(=O)C(O)=C1C2=CNC=3C=CC(=CC32)CC=C(C)C)C4=CNC=5C=CC(=CC54)CC=C(C)C

Other Names for this Substance

  • 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3,6-bis[5-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]-
  • Cochliodinol
  • 2,5-Cyclohexadiene-1,4-dione, 2,5-dihydroxy-3,6-bis[5-(3-methyl-2-butenyl)-1H-indol-3-yl]-
  • 2,5-Dihydroxy-3,6-bis[5-(3-methyl-2-buten-1-yl)-1H-indol-3-yl]-2,5-cyclohexadiene-1,4-dione
  • NSC 695240

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