1,4-Bis[[(8α,9R)-10,11-dihydro-6′-methoxycinchonan-9-yl]oxy]-9,10-anthracenedione

CAS Registry Number®

176097-24-8

CAS Name

1,4-Bis[[(8α,9R)-10,11-dihydro-6′-methoxycinchonan-9-yl]oxy]-9,10-anthracenedione

Molecular Formula

C54H56N4O6

Molecular Mass

857.05

Cite this Page

1,4-Bis[[(8α,9R)-10,11-dihydro-6′-methoxycinchonan-9-yl]oxy]-9,10-anthracenedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=176097-24-8 (retrieved 2024-11-21) (CAS RN: 176097-24-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C54H56N4O6/c1-5-31-29-57-23-19-33(31)25-45(57)53(39-17-21-55-43-13-11-35(61-3)27-41(39)43)63-47-15-16-48(50-49(47)51(59)37-9-7-8-10-38(37)52(50)60)64-54(46-26-34-20-24-58(46)30-32(34)6-2)40-18-22-56-44-14-12-36(62-4)28-42(40)44/h7-18,21-22,27-28,31-34,45-46,53-54H,5-6,19-20,23-26,29-30H2,1-4H3/t31-,32-,33-,34-,45-,46-,53+,54+/m0/s1

InChIKey

InChIKey=ARCFYUDCVYJQRN-KESJXZTCSA-N

SMILES

[C@H](OC1=C2C(=C(O[C@@H]([C@]3([N@@]4C[C@H](CC)[C@](C3)(CC4)[H])[H])C=5C6=C(C=CC(OC)=C6)N=CC5)C=C1)C(=O)C=7C(C2=O)=CC=CC7)([C@]8([N@@]9C[C@H](CC)[C@](C8)(CC9)[H])[H])C=%10C%11=C(C=CC(OC)=C%11)N=CC%10

Canonical SMILES

O=C1C=2C=CC=CC2C(=O)C=3C(OC(C=4C=CN=C5C=CC(OC)=CC54)C6N7CCC(C6)C(C7)CC)=CC=C(OC(C=8C=CN=C9C=CC(OC)=CC98)C%10N%11CCC(C%10)C(C%11)CC)C13

Other Names for this Substance

  • 9,10-Anthracenedione, 1,4-bis[[(8α,9R)-10,11-dihydro-6′-methoxycinchonan-9-yl]oxy]-
  • 1,4-Bis[[(8α,9R)-10,11-dihydro-6′-methoxycinchonan-9-yl]oxy]-9,10-anthracenedione
  • (DHQ)2AQN
  • 1,4-Bis(dihydroquinine)anthraquinone
  • 1,4-Bis(9-O-dihydroquininyl)anthraquinone

CAS INSIGHTSTM
Targeted protein degrader structure, illustration