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5,8-Ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecine-12,15(1H,11H)-dione, 1-[2-(dimethylamino)-3-(1H-indol-3-yl)-1-oxopropyl]-2,3,3a,13,14,15a-hexahydro-13-(2-methylpropyl)-
SpectraBase Compound ID IhbR4vlrht6
InChI InChI=1S/C32H39N5O4/c1-20(2)17-26-30(38)33-15-13-21-9-11-23(12-10-21)41-28-14-16-37(29(28)31(39)35-26)32(40)27(36(3)4)18-22-19-34-25-8-6-5-7-24(22)25/h5-13,15,19-20,26-29,34H,14,16-18H2,1-4H3,(H,33,38)(H,35,39)/b15-13-
InChIKey UGXWWFQLBWKALP-SQFISAMPSA-N
Mol Weight 557.7 g/mol
Molecular Formula C32H39N5O4
Exact Mass 557.300205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IYzVbiSjeTH
Name 5,8-Ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecine-12,15(1H,11H)-dione, 1-[2-(dimethylamino)-3-(1H-indol-3-yl)-1-oxopropyl]-2,3,3a,13,14,15a-hexahydro-13-(2-methylpropyl)-
CAS Registry Number 52617-27-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H39N5O4
InChI InChI=1S/C32H39N5O4/c1-20(2)17-26-30(38)33-15-13-21-9-11-23(12-10-21)41-28-14-16-37(29(28)31(39)35-26)32(40)27(36(3)4)18-22-19-34-25-8-6-5-7-24(22)25/h5-13,15,19-20,26-29,34H,14,16-18H2,1-4H3,(H,33,38)(H,35,39)/b15-13-
InChIKey UGXWWFQLBWKALP-SQFISAMPSA-N
Molecular Weight 557.695 g/mol
SMILES N1C(C(N\C=C/c2ccc(OC3C(N(C(C(Cc4c[nH]c5c4cccc5)N(C)C)=O)CC3)C1=O)cc2)=O)CC(C)C
SPLASH splash10-004r-1700900000-b4a17973e840539ce378
Source of Spectrum W5-1989-29427-0
Synonyms 6-[2-(dimethylamino)-3-(1H-indol-3-yl)propanoyl]-10-isobutyl-2-oxa-6,9,12-triazatricyclo[13.2.2.0(3,7)]nonadeca-1(17),13,15,18-tetraene-8,11-dione Amphibine-G
Wiley ID 1406496