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SERINE_AURISTATIN_TP
SpectraBase Compound ID Lp48sYj32hd
InChI InChI=1S/C42H73N6O13P/c1-13-27(6)37(47(10)41(53)35(25(2)3)44-40(52)36(26(4)5)46(8)9)33(58-11)23-34(50)48-22-14-15-32(48)38(59-12)28(7)39(51)43-21-20-29-16-18-30(19-17-29)60-62(56,57)61-45-31(24-49)42(54)55/h16-19,25-28,31-33,35-38,45,49H,13-15,20-24H2,1-12H3,(H,43,51)(H,44,52)(H,54,55)(H,56,57)/t27-,28+,31-,32-,33+,35-,36-,37-,38+/m0/s1
InChIKey UZMKQLLCYRHYBH-PGMKBNQYSA-N
Mol Weight 901.0 g/mol
Molecular Formula C42H73N6O13P
Exact Mass 900.497323 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AceqzAdSXvg
Name SERINE_AURISTATIN_TP
Compound Number 3G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H72N6O13P
InChI InChI=1S/C42H73N6O13P/c1-13-27(6)37(47(10)41(53)35(25(2)3)44-40(52)36(26(4)5)46(8)9)33(58-11)23-34(50)48-22-14-15-32(48)38(59-12)28(7)39(51)43-21-20-29-16-18-30(19-17-29)60-62(56,57)61-45-31(24-49)42(54)55/h16-19,25-28,31-33,35-38,45,49H,13-15,20-24H2,1-12H3,(H,43,51)(H,44,52)(H,54,55)(H,56,57)/t27-,28+,31-,32-,33+,35-,36-,37-,38+/m0/s1
InChIKey UZMKQLLCYRHYBH-PGMKBNQYSA-N
Literature Reference Author G.R.PETTIT,F.HOGAN,S.TOMS
Literature Reference Citation J.NAT.PROD.,74,962(2011)
Literature Reference DOI 10.1021/np1007334
Solvent CD3OD
Source File Reference UWMZ38056