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(+)-12-HYDROXYAEROTHIONIN

Compound with spectra: 1 NMR

(+)-12-HYDROXYAEROTHIONIN
SpectraBase Compound ID 4smOBw00ACX
InChI InChI=1S/C25H28Br4N4O9/c1-39-18-12(26)7-24(20(35)16(18)28)9-14(32-41-24)22(37)30-5-3-11(34)4-6-31-23(38)15-10-25(42-33-15)8-13(27)19(40-2)17(29)21(25)36/h7-8,11,20-21,34-36H,3-6,9-10H2,1-2H3,(H,30,37)(H,31,38)/t20-,21-,24+,25+/m0/s1
InChIKey QFEIAPMHJHHUFB-KXTAGPOFSA-N
Mol Weight 848.13 g/mol
Molecular Formula C25H28Br4N4O9
Exact Mass 843.85898 g/mol
Enantiomer InChIKey QFEIAPMHJHHUFB-ZLSIYFNSSA-N

View Spectrum of (+)-12-HYDROXYAEROTHIONIN

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6
N-[(5-S,10-R)-7,9-DIBROMO-10-HYDROXY-8-METHOXY-1-OXA-2-AZASPIRO-[4.5]-DECA-2,6,8-TRIENE-3-CARBONYL]-4-AMINOBUTANOIC_ACID
AEROTHIONIN
AEROTHIONINE
QRCHFTPWKYEDNH-CJNGLKHVSA-N
METHYL-4-[(5S,10R)-7,9-DIBROMO-10-HYDROXY-8-METHOXY-1-OXA-2-AZASPIRO-[4.5]-DECA-2,6,8-TRIENECARBOXAMIDO]-3-OXO-BUTYLCARBAMATE
ISGFGLUJCCUWLK-FMKPAKJESA-N
(1'S)-5,6-Epoxy-3-bromo-3'-(benzylamido)spiro[4,5-dihydroisoxazole-5,1'-cyclohex-2'-en-4'-one]
PSAMMAPLYSIN-E
PSAMMAPLYSIN_Y
PSAMMAPLYSIN_U
Title Journal or Book Year
Bioactive Constituents from the Marine Crinoid Himerometra magnipinna Journal of Natural Products 2007
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