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LUCEDENIC-ACID-P;3-BETA,7-BETA-DIHYDROXY-12-BETA-ACETOXY-25,26,27-TRINOR-11,15-DIOXOLANOST-8-EN-24-OIC-ACID
SpectraBase Compound ID FuAJzhZEekm
InChI InChI=1S/C29H42O8/c1-14(8-9-21(34)35)16-12-20(33)29(7)22-17(31)13-18-26(3,4)19(32)10-11-27(18,5)23(22)24(36)25(28(16,29)6)37-15(2)30/h14,16-19,25,31-32H,8-13H2,1-7H3,(H,34,35)/t14-,16-,17+,18+,19+,25-,27+,28+,29+/m1/s1
InChIKey QPEKELRREXLZJP-WGULIUFBSA-N
Mol Weight 518.6 g/mol
Molecular Formula C29H42O8
Exact Mass 518.287968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ix3vU1gwBKp
Name LUCEDENIC-ACID-P;3-BETA,7-BETA-DIHYDROXY-12-BETA-ACETOXY-25,26,27-TRINOR-11,15-DIOXOLANOST-8-EN-24-OIC-ACID
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H42O8
InChI InChI=1S/C29H42O8/c1-14(8-9-21(34)35)16-12-20(33)29(7)22-17(31)13-18-26(3,4)19(32)10-11-27(18,5)23(22)24(36)25(28(16,29)6)37-15(2)30/h14,16-19,25,31-32H,8-13H2,1-7H3,(H,34,35)/t14-,16-,17+,18+,19+,25-,27+,28+,29+/m1/s1
InChIKey QPEKELRREXLZJP-WGULIUFBSA-N
Literature Reference Author K.IWATSUKI,T.AKIHISA,H.TOKUDA,M.UKIYA,M.OSHIKUBO,Y.KIMURA,T. ASANO,A.NOMURA,H.NIS
Literature Reference Citation J.NAT.PROD.,66,1582(2003)
Literature Reference DOI 10.1021/np0302293
Molecular Weight 518.648 g/mol
Solvent CDCl3
Source File Reference UWKP3198