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1H-Isoindolo[3'a,4':6,7]cycloundeca[1,2-b]quinoxaline-1,19(2H)-dione, 3,3a,4,6a,9,10,17,18-octahydro-4,5,8-trimethyl-3-(2-methylpropyl)-, [3S-(3.alpha.,3a.alpha.,4.beta.,6a.alpha.,19aR*)]-
SpectraBase Compound ID DSCuRob4Psr
InChI InChI=1S/C30H37N3O2/c1-16(2)12-25-26-21-15-19(5)18(4)14-20(21)13-17(3)10-11-24-28(29(34)27(26)30(35)33-25)32-23-9-7-6-8-22(23)31-24/h6-9,13-14,16,19-21,25-27H,10-12,15H2,1-5H3,(H,33,35)/b17-13-
InChIKey LZRJTOUDKLAOET-LGMDPLHJSA-N
Mol Weight 471.6 g/mol
Molecular Formula C30H37N3O2
Exact Mass 471.288577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n0jUB53not
Name 1H-Isoindolo[3'a,4':6,7]cycloundeca[1,2-b]quinoxaline-1,19(2H)-dione, 3,3a,4,6a,9,10,17,18-octahydro-4,5,8-trimethyl-3-(2-methylpropyl)-, [3S-(3.alpha.,3a.alpha.,4.beta.,6a.alpha.,19aR*)]-
CAS Registry Number 72363-45-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H37N3O2
InChI InChI=1S/C30H37N3O2/c1-16(2)12-25-26-21-15-19(5)18(4)14-20(21)13-17(3)10-11-24-28(29(34)27(26)30(35)33-25)32-23-9-7-6-8-22(23)31-24/h6-9,13-14,16,19-21,25-27H,10-12,15H2,1-5H3,(H,33,35)/b17-13-
InChIKey LZRJTOUDKLAOET-LGMDPLHJSA-N
Molecular Weight 471.645 g/mol
SMILES N1C(C2C3C(\C=C/(CCc4nc5ccccc5nc4C(C2C1=O)=O)C)C=C(C(C3)C)C)CC(C)C
SPLASH splash10-00di-2120900000-888a36c7ad760dbaf807
Source of Spectrum H-62-1517-0
Synonyms 3-isobutyl-5,6,9-trimethyl-2,3,3a,3b,4,5,7a,10,11,18a-decahydrobenzo[6,7]pyrrolo[3',4':4,5]cycloundeca[1,2-b]quinoxaline-1,18-dione Quinoxaline derivative of aspochalasin A
Wiley ID 1393151