CEP 2563

CAS Registry Number®

183488-70-2

CAS Name

CEP 2563

Molecular Formula

C36H40N6O6.2ClH

Cite this Page

CEP 2563.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=183488-70-2 (retrieved 2024-11-22) (CAS RN: 183488-70-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H40N6O6.2ClH/c1-35-36(46-2,19-47-27(43)14-16-39-33(44)23(38)11-7-8-15-37)17-26(48-35)41-24-12-5-3-9-20(24)29-30-22(18-40-34(30)45)28-21-10-4-6-13-25(21)42(35)32(28)31(29)41;;/h3-6,9-10,12-13,23,26H,7-8,11,14-19,37-38H2,1-2H3,(H,39,44)(H,40,45);2*1H/t23-,26+,35-,36-;;/m0../s1

InChIKey

InChIKey=PBEVPBFDKPJIOM-HQKLUXGTSA-N

SMILES

C[C@]12N3C=4C5=C(C6=C(C4C=7C3=CC=CC7)CNC6=O)C=8C(N5[C@](O1)(C[C@@]2(COC(CCNC([C@H](CCCCN)N)=O)=O)OC)[H])=CC=CC8.Cl

Canonical SMILES

Cl.O=C(OCC1(OC)CC2OC1(N3C=4C=CC=CC4C=5C3=C6C(C7=CC=CC=C7N62)=C8C(=O)NCC85)C)CCNC(=O)C(N)CCCCN

Other Names for this Substance

  • β-Alanine, L-lysyl-, [(9S,10S,12R)-2,3,9,10,11,12-hexahydro-10-methoxy-9-methyl-1-oxo-9,12-epoxy-1H-diindolo[1,2,3-fg:3′,2′,1′-kl]pyrrolo[3,4-i][1,6]benzodiazocin-10-yl]methyl ester, hydrochloride (1:2)
  • β-Alanine, N-L-lysyl-, (2,3,9,10,11,12-hexahydro-10-methoxy-9-methyl-1-oxo-9,12-epoxy-1H-diindolo[1,2,3-fg:3′,2′,1′-kl]pyrrolo[3,4-i][1,6]benzodiazocin-10-yl)methyl ester, dihydrochloride, [9S-(9α,10β,12α)]-
  • β-Alanine, L-lysyl-, [(9S,10S,12R)-2,3,9,10,11,12-hexahydro-10-methoxy-9-methyl-1-oxo-9,12-epoxy-1H-diindolo[1,2,3-fg:3′,2′,1′-kl]pyrrolo[3,4-i][1,6]benzodiazocin-10-yl]methyl ester, dihydrochloride
  • CEP 2563
  • KT 8391

Deleted or Replaced CAS Registry Numbers

199280-59-6

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