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DESTRUXIN-A(I)
SpectraBase Compound ID DulioDuYGPF
InChI InChI=1S/C29H47N5O7/c1-9-12-21-27(38)34-16-11-13-20(34)26(37)31-23(18(5)10-2)28(39)33(8)24(17(3)4)29(40)32(7)19(6)25(36)30-15-14-22(35)41-21/h9,17-21,23-24H,1,10-16H2,2-8H3,(H,30,36)(H,31,37)
InChIKey XIYSEKITPHTMJT-UHFFFAOYSA-N
Mol Weight 577.7 g/mol
Molecular Formula C29H47N5O7
Exact Mass 577.347549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JvPAkY80Tny
Name Destruxin a
CAS Registry Number 6686-70-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H47N5O7
InChI InChI=1S/C29H47N5O7/c1-9-12-21-27(38)34-16-11-13-20(34)26(37)31-23(18(5)10-2)28(39)33(8)24(17(3)4)29(40)32(7)19(6)25(36)30-15-14-22(35)41-21/h9,17-21,23-24H,1,10-16H2,2-8H3,(H,30,36)(H,31,37)
InChIKey XIYSEKITPHTMJT-UHFFFAOYSA-N
Molecular Weight 577.723 g/mol
SMILES N1C(C2N(C(C(OC(CCNC(C(N(C(C(N(C(C1C(CC)C)=O)C)C(C)C)=O)C)C)=O)=O)CC=C)=O)CCC2)=O
SPLASH splash10-00du-0001960000-a64bfd73f8a845b80393
Source of Spectrum O-4-177-1
Synonyms .beta.-alanine, N-[n-[n-[n-[1-(D-2-hydroxy-1-oxo-4-pentenyl)-L-prolyl]-L-isoleucyl]-N-methyl-L-valyl]-N-methyl-L-alanyl]-, .rho.-lactone BRN 0601694
Wiley ID 1408290