20-Oxa-5,7,14,27-tetraazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2,4,6(27),8,10,12(26),16,21,23-decaene, 14-methyl-, (16E)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)

CAS Registry Number®

1204918-73-9
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CAS Name

20-Oxa-5,7,14,27-tetraazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2,4,6(27),8,10,12(26),16,21,23-decaene, 14-methyl-, (16E)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)

Molecular Formula

C23H24N4O.C6H8O7

Cite this Page

20-Oxa-5,7,14,27-tetraazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2,4,6(27),8,10,12(26),16,21,23-decaene, 14-methyl-, (16E)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1204918-73-9 (retrieved 2023-12-02) (CAS RN: 1204918-73-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H21N3O.C6H8O7.CH5N.CH4/c1-3-4-13-25-19-10-6-8-17(15-19)20-11-12-22-21(24-20)23-18-9-5-7-16(2)14-18;7-3(8)1-6(13,5(11)12)2-4(9)10;1-2;/h3,5-12,14-15H,1,4,13H2,2H3,(H,22,23,24);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);2H2,1H3;1H4

InChIKey

InChIKey=ZNGXBBJRRYGHHR-UHFFFAOYSA-N

SMILES

C(CC(O)=O)(CC(O)=O)(C(O)=O)O.CN1CC2=CC(N=C3NC(C=4C=C(C=CC4)OCCC=CC1)=CC=N3)=CC=C2

Canonical SMILES

O=C(O)CC(O)(C(=O)O)CC(=O)O.N1=CC=C2NC1=NC=3C=CC=C(C3)CN(C)CC=CCCOC=4C=CC=C2C4

Other Names for this Substance

  • 20-Oxa-5,7,14,27-tetraazatetracyclo[19.3.1.12,6.18,12]heptacosa-1(25),2,4,6(27),8,10,12(26),16,21,23-decaene, 14-methyl-, (16E)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
  • Zotiraciclib citrate
  • TG 02 citrate
  • (6E)-9-methyl-3-oxa-9,12-diaza-1(4,2)-pyrimidina-2,11(1,3)dibenzenacyclododecaphan-6-ene 2-hydroxypropane-1,2,3-tricarboxylate (1:1)