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5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl]amino}pentanoic acid
SpectraBase Compound ID QrT4dhySZg
InChI InChI=1S/C23H35NO5S/c1-2-16-29-23(28)21-17-12-9-7-5-3-4-6-8-10-13-18(17)30-22(21)24-19(25)14-11-15-20(26)27/h2-16H2,1H3,(H,24,25)(H,26,27)
InChIKey OOBLGBLOMPAVHM-UHFFFAOYSA-N
Mol Weight 437.6 g/mol
Molecular Formula C23H35NO5S
Exact Mass 437.223594 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 77AAJH0U4E2
Name 5-oxo-5-{[3-(propoxycarbonyl)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thien-2-yl]amino}pentanoic acid
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H35NO5S/c1-2-16-29-23(28)21-17-12-9-7-5-3-4-6-8-10-13-18(17)30-22(21)24-19(25)14-11-15-20(26)27/h2-16H2,1H3,(H,24,25)(H,26,27)
InChIKey OOBLGBLOMPAVHM-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_20128
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9158295; UBI_ID: UBI-020132
Temperature 318 °C