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7-Oxa-15,20,24,27-tetraazatetracyclo[13.9.6.2(8,11).1(2,6)]tritriaconta-2,4,6(33),8,10,12,31-heptaene-14,26-dione, 20-acetyl-5-methoxy-, [s-(Z)]-
SpectraBase Compound ID 6NCvbSMc9nt
InChI InChI=1S/C31H40N4O5/c1-23(36)34-17-3-4-18-35-20-6-16-33-30(37)22-27(32-15-5-19-34)25-10-13-28(39-2)29(21-25)40-26-11-7-24(8-12-26)9-14-31(35)38/h7-14,21,27,32H,3-6,15-20,22H2,1-2H3,(H,33,37)/b14-9-
InChIKey OYYHWFZZGWEJQX-ZROIWOOFSA-N
Mol Weight 548.7 g/mol
Molecular Formula C31H40N4O5
Exact Mass 548.29987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KNY60sO9e5R
Name 7-Oxa-15,20,24,27-tetraazatetracyclo[13.9.6.2(8,11).1(2,6)]tritriaconta-2,4,6(33),8,10,12,31-heptaene-14,26-dione, 20-acetyl-5-methoxy-, [s-(Z)]-
CAS Registry Number 40135-65-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H40N4O5
InChI InChI=1S/C31H40N4O5/c1-23(36)34-17-3-4-18-35-20-6-16-33-30(37)22-27(32-15-5-19-34)25-10-13-28(39-2)29(21-25)40-26-11-7-24(8-12-26)9-14-31(35)38/h7-14,21,27,32H,3-6,15-20,22H2,1-2H3,(H,33,37)/b14-9-
InChIKey OYYHWFZZGWEJQX-ZROIWOOFSA-N
Molecular Weight 548.684 g/mol
SMILES N1C2CC(=O)NCCCN(C(\C=C/c3ccc(Oc4c(ccc2c4)OC)cc3)=O)CCCCN(CCC1)C(C)=O
SPLASH splash10-0006-9541110000-4354fe97ae5be16d096f
Source of Spectrum H-56-1272-3
Synonyms Chenorhine Chenorrhine
Wiley ID 1405477