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Pentanamide, 2-(dimethylamino)-N-[1-(1H-indol-3-ylmethyl)-2-[3,3a,11,12,13,14,15,15a-octahydro-13-(1-methylpropyl)-12,15-dioxo-5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecin-1(2H)-yl]-2-oxoethyl]-4-methyl-
SpectraBase Compound ID A74EG1khjUI
InChI InChI=1S/C38H50N6O5/c1-7-24(4)33-36(46)39-18-16-25-12-14-27(15-13-25)49-32-17-19-44(34(32)37(47)42-33)38(48)30(41-35(45)31(43(5)6)20-23(2)3)21-26-22-40-29-11-9-8-10-28(26)29/h8-16,18,22-24,30-34,40H,7,17,19-21H2,1-6H3,(H,39,46)(H,41,45)(H,42,47)/b18-16-
InChIKey GAIJJGBWWFCJPU-VLGSPTGOSA-N
Mol Weight 670.9 g/mol
Molecular Formula C38H50N6O5
Exact Mass 670.384269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FyAzYiB8y4s
Name Pentanamide, 2-(dimethylamino)-N-[1-(1H-indol-3-ylmethyl)-2-[3,3a,11,12,13,14,15,15a-octahydro-13-(1-methylpropyl)-12,15-dioxo-5,8-ethenopyrrolo[3,2-b][1,5,8]oxadiazacyclotetradecin-1(2H)-yl]-2-oxoethyl]-4-methyl-
Alternate Name(s) Amphibine E
CAS Registry Number 38541-75-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H50N6O5
InChI InChI=1S/C38H50N6O5/c1-7-24(4)33-36(46)39-18-16-25-12-14-27(15-13-25)49-32-17-19-44(34(32)37(47)42-33)38(48)30(41-35(45)31(43(5)6)20-23(2)3)21-26-22-40-29-11-9-8-10-28(26)29/h8-16,18,22-24,30-34,40H,7,17,19-21H2,1-6H3,(H,39,46)(H,41,45)(H,42,47)/b18-16-
InChIKey GAIJJGBWWFCJPU-VLGSPTGOSA-N
Molecular Weight 670.855 g/mol
SMILES N1C(C2C(CCN2C(C(Cc2c[nH]c3ccccc23)NC(=O)C(CC(C)C)N(C)C)=O)Oc2ccc(\C=C/NC(C1C(CC)C)=O)cc2)=O
SPLASH splash10-03di-2900000000-dd55dfbb7d83639609f3
Source of Spectrum K-105-3099-4
Wiley ID 1413913