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4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-methoxyphenyl)-10-methyl-
SpectraBase Compound ID KpXiLonXeh4
InChI InChI=1S/C30H40N4O4/c1-33-16-3-4-18-34-19-7-15-32-26(35)20-24(31-14-6-17-33)23-8-5-9-25-27(23)28(30(34)36)29(38-25)21-10-12-22(37-2)13-11-21/h5,8-13,24,28-29,31H,3-4,6-7,14-20H2,1-2H3,(H,32,35)
InChIKey ZVORBYAWSAWUEE-UHFFFAOYSA-N
Mol Weight 520.7 g/mol
Molecular Formula C30H40N4O4
Exact Mass 520.304956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ApCSGuyj75o
Name 4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-methoxyphenyl)-10-methyl-
Alternate Name(s) N,O(34)-Dimethylaphelandrin N,O(34)-Dimethylaphelandrine N,O-Dimethylaphelandrine
CAS Registry Number 69682-28-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H40N4O4
InChI InChI=1S/C30H40N4O4/c1-33-16-3-4-18-34-19-7-15-32-26(35)20-24(31-14-6-17-33)23-8-5-9-25-27(23)28(30(34)36)29(38-25)21-10-12-22(37-2)13-11-21/h5,8-13,24,28-29,31H,3-4,6-7,14-20H2,1-2H3,(H,32,35)
InChIKey ZVORBYAWSAWUEE-UHFFFAOYSA-N
Molecular Weight 520.674 g/mol
SMILES N1C(CC2c3c4C(C(N(CCCCN(CCCN2)C)CCC1)=O)C(Oc4ccc3)c1ccc(cc1)OC)=O
SPLASH splash10-00e9-5490250000-9e08ea3b927c57b43bb1
Source of Spectrum H-61-2661-0
Wiley ID 1401991