Neoquassin

CAS Registry Number®

76-77-7

CAS Name

Neoquassin

Molecular Formula

C22H30O6

Molecular Mass

390.47

Cite this Page

Neoquassin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=76-77-7 (retrieved 2024-11-22) (CAS RN: 76-77-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    227 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C22H30O6/c1-10-7-14(26-5)20(25)22(4)12(10)8-15-21(3)13(9-16(23)28-15)11(2)18(27-6)17(24)19(21)22/h7,10,12-13,15-16,19,23H,8-9H2,1-6H3

InChIKey

InChIKey=BDQNCUODBJZKIY-UHFFFAOYSA-N

SMILES

CC12C3C4(C)C(CC1OC(O)CC2C(C)=C(OC)C3=O)C(C)C=C(OC)C4=O

Canonical SMILES

O=C1C(OC)=C(C)C2CC(O)OC3CC4C(C=C(OC)C(=O)C4(C)C1C32C)C

Other Names for this Substance

  • Picrasa-2,12-diene-1,11-dione, 16-hydroxy-2,12-dimethoxy-
  • Neoquassin
  • Phenanthro[10,1-bc]pyran-1,11-dione, 3a,4,5,6a,7,7a,8,11a,11b,11c-decahydro-5-hydroxy-2,10-dimethoxy-3,8,11a,11c-tetramethyl-
  • Phenanthro[10,1-bc]pyran, picrasa-2,12-diene-1,11-dione deriv.
  • 16-Hydroxy-2,12-dimethoxypicrasa-2,12-diene-1,11-dione

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Deleted or Replaced CAS Registry Numbers

32727-23-4

CAS INSIGHTSTM
Targeted protein degrader structure, illustration