For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Acetamide, N-[3-(acetylamino)propyl]-N-[4-[15-hydroxy-2-[(4-methoxyphenyl)methyl]-3,9-dioxo-4,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-4-yl]b utyl]-, (S)-
SpectraBase Compound ID LRq3cxR2g6d
InChI InChI=1S/C33H46N4O6/c1-24(38)34-16-6-20-36(25(2)39)18-4-5-19-37-21-7-17-35-32(41)15-11-27-10-14-31(40)29(22-27)30(33(37)42)23-26-8-12-28(43-3)13-9-26/h8-10,12-14,22,30,40H,4-7,11,15-21,23H2,1-3H3,(H,34,38)(H,35,41)/t30-/m0/s1
InChIKey PZXYQWMFIJZCHY-PMERELPUSA-N
Mol Weight 594.8 g/mol
Molecular Formula C33H46N4O6
Exact Mass 594.341735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3wzJYVzrRPh
Name Acetamide, N-[3-(acetylamino)propyl]-N-[4-[15-hydroxy-2-[(4-methoxyphenyl)methyl]-3,9-dioxo-4,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-4-yl]b utyl]-, (S)-
CAS Registry Number 73710-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H46N4O6
InChI InChI=1S/C33H46N4O6/c1-24(38)34-16-6-20-36(25(2)39)18-4-5-19-37-21-7-17-35-32(41)15-11-27-10-14-31(40)29(22-27)30(33(37)42)23-26-8-12-28(43-3)13-9-26/h8-10,12-14,22,30,40H,4-7,11,15-21,23H2,1-3H3,(H,34,38)(H,35,41)/t30-/m0/s1
InChIKey PZXYQWMFIJZCHY-PMERELPUSA-N
Molecular Weight 594.753 g/mol
SMILES N1CCCN(C([C@](c2c(ccc(c2)CCC1=O)O)(Cc1ccc(cc1)OC)[H])=O)CCCCN(C(=O)C)CCCNC(=O)C
SPLASH splash10-00dl-3911040000-44ce3cba382c45f041c6
Source of Spectrum H-62-2722-0
Synonyms 4,8-Diazabicyclo[10.3.1]hexadecane, acetamide deriv. N(6),n(10)-diacetyl-o(34)-methyl-10,11:16,17-diseco-orantin N,N'-diacetyl-O-methyl-10,11:16,17-disecoorantine N-[3-(acetylamino)propyl]-N-{4-[(2S)-15-hydroxy-2-(4-methoxybenzyl)-3,9-dioxo-4,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-4-yl]butyl}acetamide
Wiley ID 1409646