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3H-Pyrrolo[4,3,2-gh]-1,4-benzodiazonin-3-one, 9-(1-ethenyl-4-hydroxy-1,4,5-trimethylhexyl)-1,2,4,5,6,8-hexahydro-5-(methoxymethyl)-1-methyl-2-(1-methylethyl)-
SpectraBase Compound ID DwRoovJ2mnj
InChI InChI=1S/C29H45N3O3/c1-10-28(6,13-14-29(7,34)19(4)5)22-11-12-23-24-20(16-30-25(22)24)15-21(17-35-9)31-27(33)26(18(2)3)32(23)8/h10-12,16,18-19,21,26,30,34H,1,13-15,17H2,2-9H3,(H,31,33)
InChIKey WEUZJJDCWFFQKO-UHFFFAOYSA-N
Mol Weight 483.7 g/mol
Molecular Formula C29H45N3O3
Exact Mass 483.346092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FOMGMPcN2f
Name 3H-Pyrrolo[4,3,2-gh]-1,4-benzodiazonin-3-one, 9-(1-ethenyl-4-hydroxy-1,4,5-trimethylhexyl)-1,2,4,5,6,8-hexahydro-5-(methoxymethyl)-1-methyl-2-(1-methylethyl)-
CAS Registry Number 110064-64-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H45N3O3
InChI InChI=1S/C29H45N3O3/c1-10-28(6,13-14-29(7,34)19(4)5)22-11-12-23-24-20(16-30-25(22)24)15-21(17-35-9)31-27(33)26(18(2)3)32(23)8/h10-12,16,18-19,21,26,30,34H,1,13-15,17H2,2-9H3,(H,31,33)
InChIKey WEUZJJDCWFFQKO-UHFFFAOYSA-N
Molecular Weight 483.697 g/mol
SMILES [nH]1cc2c3c(ccc(C(CCC(C(C)C)(O)C)(C=C)C)c13)N(C(C(NC(C2)COC)=O)C(C)C)C
SPLASH splash10-014i-0005900000-a94f867caa46df8ab10c
Source of Spectrum F-46-2778-6
Synonyms 9-[1-(3-hydroxy-3,4-dimethylpentyl)-1-methyl-2-propenyl]-2-isopropyl-5-(methoxymethyl)-1-methyl-1,2,4,5,6,8-hexahydro-3H-[1,4]diazonino[7,6,5-cd]indol-3-one Blastmycetin D Blastmycin D
Wiley ID 1395866