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21H-Biline-1,3,19(2H)-trione, 17-ethyl-23,24-dihydro-2,2,7,8,12,13,18-heptamethyl-
SpectraBase Compound ID GYI4UIvwfDf
InChI InChI=1S/C28H32N4O3/c1-9-18-17(6)26(34)31-23(18)11-21-15(4)13(2)19(29-21)10-20-14(3)16(5)22(30-20)12-24-25(33)28(7,8)27(35)32-24/h10-12,29H,9H2,1-8H3,(H,31,34)(H,32,35)/b20-10+,23-11-,24-12-
InChIKey BFRNJOLUEZHLPC-OBETUOBNSA-N
Mol Weight 472.6 g/mol
Molecular Formula C28H32N4O3
Exact Mass 472.247441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbXvaxJtAcl
Name 21H-Biline-1,3,19(2H)-trione, 17-ethyl-23,24-dihydro-2,2,7,8,12,13,18-heptamethyl-
CAS Registry Number 87233-11-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32N4O3
InChI InChI=1S/C28H32N4O3/c1-9-18-17(6)26(34)31-23(18)11-21-15(4)13(2)19(29-21)10-20-14(3)16(5)22(30-20)12-24-25(33)28(7,8)27(35)32-24/h10-12,29H,9H2,1-8H3,(H,31,34)(H,32,35)/b20-10+,23-11-,24-12-
InChIKey BFRNJOLUEZHLPC-OBETUOBNSA-N
Molecular Weight 472.589 g/mol
SMILES N1\C(=C/C2=N\C(=C\c3c(c(c(\C=C/4NC(C(=C4CC)C)=O)[nH]3)C)C)C(=C2C)C)C(C(C)(C)C1=O)=O
SPLASH splash10-00dl-3020900000-e6ffebde838fff4c4543
Source of Spectrum AH-114-767-0
Synonyms (4E,10Z,15Z)-17-ethyl-1,3,19-trioxo-2,2,7,8,12,13,18-hepta-methyl-1,2,3,19,23,24-hexahydro-21H-biline (4Z,9Z,15Z)-17-ethyl-1,3,19-trioxo-2,2,7,8,12,13,18-hepta-methyl-1,2,3,19,23,24-hexahydro-21H-biline (5Z)-5-{[(2E)-2-({5-[(Z)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-3,4-dimethyl-1H-pyrrol-2-yl}methylene)-3,4-dimethyl-2H-pyrrol-5-yl]methylene}-3,3-dimethyl-2,4-pyrrolidinedione
Wiley ID 1393424