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

*Links on SpectraBase are not permalinks.

1H,14H-13,10:20,17-Dinitrilo-21H-pyrrolo[2,1-l][1,17,4,7,10,13,20]dithiapentaazacyclotricosine-9-propanamide, 2,3,4,5,6,7,8,9,15,16,23,24,25,25a-tetradecahydro-6-(1-methylethyl)-3-(2-methylpropyl)-1,4,7,14,21-pentaoxo-, [3S-(3R*,6R*,9S*,25aR*)]-

Compound with spectra: 1 MS (GC)

1H,14H-13,10:20,17-Dinitrilo-21H-pyrrolo[2,1-l][1,17,4,7,10,13,20]dithiapentaazacyclotricosine-9-propanamide, 2,3,4,5,6,7,8,9,15,16,23,24,25,25a-tetradecahydro-6-(1-methylethyl)-3-(2-methylpropyl)-1,4,7,14,21-pentaoxo-, [3S-(3R*,6R*,9S*,25aR*)]-
SpectraBase Compound ID KCs1ixdTrn
InChI InChI=1S/C29H40N8O6S2/c1-14(2)10-17-25(40)36-23(15(3)4)27(42)33-16(7-8-21(30)38)28-35-18(12-45-28)24(39)31-11-22-32-19(13-44-22)29(43)37-9-5-6-20(37)26(41)34-17/h12-17,20,23H,5-11H2,1-4H3,(H2,30,38)(H,31,39)(H,33,42)(H,34,41)(H,36,40)/t16?,17-,20-,23+/m1/s1
InChIKey XEUXVSVRYSKWPZ-SNZHDBJPSA-N
Mol Weight 660.8 g/mol
Molecular Formula C29H40N8O6S2
Exact Mass 660.251223 g/mol
Enantiomer InChIKey XEUXVSVRYSKWPZ-RHZRSWMVSA-N

View Spectrum of 1H,14H-13,10:20,17-Dinitrilo-21H-pyrrolo[2,1-l][1,17,4,7,10,13,20]dithiapentaazacyclotricosine-9-propanamide, 2,3,4,5,6,7,8,9,15,16,23,24,25,25a-tetradecahydro-6-(1-methylethyl)-3-(2-methylpropyl)-1,4,7,14,21-pentaoxo-, [3S-(3R*,6R*,9S*,25aR*)]-

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum J-51-4585-0
Dolastin 3
DOLASTATIN-3
11H-10,7:17,14-Dinitrilo-7H-pyrrolo[2,1-i][1,17,4,7,10,13,20]dithiapentaazacyclotricosine-6-propanamide, 1,2,3,4,5,6,12,13,18,19,20,21,23,24,25,25a-hexadecahydro-20-(1-methylethyl)-3-(2-methylpropyl)-1,4,11,18,21-pentaoxo-, [3S-(3R*,6R*,20R*,25aR*)]-
MOLLAMIDE_C
ULITHIACYClAMIDE_B
OXYTOCIN;OXT
1-[19-amino-7-(2-amino-2-keto-ethyl)-10-(3-amino-3-keto-propyl)-16-(4-hydroxybenzyl)-6,9,12,15,18-pentaketo-13-sec-butyl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]-N-[1-[(2-amino-2-keto-ethyl)carbamoyl]-3-methyl-butyl]pyrrolidine-2-carboxamid
ANNOMURICATIN-B;CYCLO-(PROPYL-ASPARAGINYL-ALANYL-TRYPTOPHYL-LEUCYL-GLYCYL-THRYL)
PHAKELLISTATIN_17;CYCLO-(PRO-(1)-TRP-VAL-PRO-(2)-LEU-ILE-PRO-(3)-ILE-(2))
DOMINICIN
DICHOTOMIN-I;CYClO-(-VAL-PRO-THR-PHE-TYR-PRO-LEU-ILE-)
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.