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4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 10,14-diacetyl-3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-methoxyphenyl)-
SpectraBase Compound ID HzrGpvGh4jI
InChI InChI=1S/C33H42N4O6/c1-22(38)35-15-4-5-16-36-17-6-14-34-30(40)21-28(37(23(2)39)19-7-18-35)25-10-13-29-27(20-25)31(33(36)41)32(43-29)24-8-11-26(42-3)12-9-24/h8-13,20,28,31-32H,4-7,14-19,21H2,1-3H3,(H,34,40)
InChIKey GBCFQPCJWGAUGN-UHFFFAOYSA-N
Mol Weight 590.7 g/mol
Molecular Formula C33H42N4O6
Exact Mass 590.310435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVxFDqBPnFI
Name 4H-1,16-Etheno-5,15-(propaniminoethano)furo[3,4-l][1,5,10]triazacyclohexadecine-4,21-dione, 10,14-diacetyl-3,3a,6,7,8,9,10,11,12,13,14,15-dodecahydro-3-(4-methoxyphenyl)-
Alternate Name(s) N(6),N(10)-Diacetyl-O(34)-methylaphelandrine N6,N10-Diacetyl-O-methylaphelandrine
CAS Registry Number 64366-66-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H42N4O6
InChI InChI=1S/C33H42N4O6/c1-22(38)35-15-4-5-16-36-17-6-14-34-30(40)21-28(37(23(2)39)19-7-18-35)25-10-13-29-27(20-25)31(33(36)41)32(43-29)24-8-11-26(42-3)12-9-24/h8-13,20,28,31-32H,4-7,14-19,21H2,1-3H3,(H,34,40)
InChIKey GBCFQPCJWGAUGN-UHFFFAOYSA-N
Molecular Weight 590.721 g/mol
SMILES N1C(CC2c3ccc4c(C(C(N(CCC1)CCCCN(CCCN2C(=O)C)C(=O)C)=O)C(O4)c1ccc(cc1)OC)c3)=O
SPLASH splash10-0udj-1191040000-5bdd848788686ec40313
Source of Spectrum H-62-2721-0
Wiley ID 1409347