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GNEYULIN_A

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GNEYULIN_A
SpectraBase Compound ID 9Wgfwta8ocC
InChI InChI=1S/C42H32O12/c43-23-4-3-20(32(49)15-23)2-1-19-7-35(52)40-37(8-19)54-42(39(40)22-11-27(47)14-28(48)12-22)30-17-31-36(18-34(30)51)53-41(29-6-5-24(44)16-33(29)50)38(31)21-9-25(45)13-26(46)10-21/h1-18,38-39,41-52H/b2-1+/t38-,39-,41+,42+/m1/s1
InChIKey ICXRYDWDNDYFEC-LUJHVKMYSA-N
Mol Weight 728.7 g/mol
Molecular Formula C42H32O12
Exact Mass 728.189376 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FV0iMt0x49b
Name GNEYULIN_A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H32O12
InChI InChI=1S/C42H32O12/c43-23-4-3-20(32(49)15-23)2-1-19-7-35(52)40-37(8-19)54-42(39(40)22-11-27(47)14-28(48)12-22)30-17-31-36(18-34(30)51)53-41(29-6-5-24(44)16-33(29)50)38(31)21-9-25(45)13-26(46)10-21/h1-18,38-39,41-52H/b2-1+/t38-,39-,41+,42+/m1/s1
InChIKey ICXRYDWDNDYFEC-LUJHVKMYSA-N
Literature Reference Author Y.SHIMOKAWA,Y.AKAO,Y.HIRASAWA,K.AWANG,AH.A.HADI,S.SATO,C.AOY AMA,J.TAKEO,M.SHIRO,
Literature Reference Citation J.NAT.PROD.,73,763(2010)
Literature Reference DOI 10.1021/np9007987
Molecular Weight 728.709 g/mol
Sample ID 35392
Solvent ACETONE-D6