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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*)]-

Compound with spectra: 1 MS (GC)

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*)]-
SpectraBase Compound ID 3zQQjRYhSnA
InChI InChI=1S/C29H40N8O6S2/c1-14(2)10-17-25(40)33-16(7-8-21(30)38)28-35-18(13-45-28)24(39)31-11-22-32-19(12-44-22)26(41)36-23(15(3)4)29(43)37-9-5-6-20(37)27(42)34-17/h12-17,20,23H,5-11H2,1-4H3,(H2,30,38)(H,31,39)(H,33,40)(H,34,42)(H,36,41)/t16-,17-,20-,23+/m0/s1
InChIKey ATCVYMAKQRUVDS-DOAHWQAKSA-N
Mol Weight 660.8 g/mol
Molecular Formula C29H40N8O6S2
Exact Mass 660.251223 g/mol
Enantiomer InChIKey ATCVYMAKQRUVDS-UYWGQIMJSA-N

View Spectrum of 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*)]-

MS (GC) Spectrum
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Source of Spectrum J-50-2659-1
DOLASTATIN-3
Dolastin 3
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*)]-
MOLLAMIDE_C
DICHOTOMIN-I;CYClO-(-VAL-PRO-THR-PHE-TYR-PRO-LEU-ILE-)
DOMINICIN
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))
STELLADELIN-C
AXINASTATIN-4
MICROTENIN_C;CYClO-(PRO-(1)-TYR-ASN-PHE-PRO-(2)-LEU-PRO-(3)-ILE)
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