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ORTHOSIPHOL-J;7-O-ACETYL-11-DEHYDROXY-11-OXO-ORTHOSIPHOL-G
SpectraBase Compound ID 4mQ7L4imqbG
InChI InChI=1S/C33H40O11/c1-9-31(7)16-21(37)25-32(8)22(15-23(41-17(2)34)33(25,40)29(31)39)30(5,6)26(43-19(4)36)24(42-18(3)35)27(32)44-28(38)20-13-11-10-12-14-20/h9-14,22-27,40H,1,15-16H2,2-8H3/t22-,23+,24-,25+,26+,27-,31-,32-,33-/m0/s1
InChIKey HOFNFIRZXJMXPW-LEWITGLZSA-N
Mol Weight 612.7 g/mol
Molecular Formula C33H40O11
Exact Mass 612.257062 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4b1tTHck4zR
Name ORTHOSIPHOL-J;7-O-ACETYL-11-DEHYDROXY-11-OXO-ORTHOSIPHOL-G
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H40O11
InChI InChI=1S/C33H40O11/c1-9-31(7)16-21(37)25-32(8)22(15-23(41-17(2)34)33(25,40)29(31)39)30(5,6)26(43-19(4)36)24(42-18(3)35)27(32)44-28(38)20-13-11-10-12-14-20/h9-14,22-27,40H,1,15-16H2,2-8H3/t22-,23+,24-,25+,26+,27-,31-,32-,33-/m0/s1
InChIKey HOFNFIRZXJMXPW-LEWITGLZSA-N
Literature Reference Author Y.TEZUKA,P.STAMPOULIS,A.H.BANSKOTA,S.AWALE,K.Q.TRAN,I.SAIKI, S.KADOTA
Literature Reference Citation CHEM.PHARM.BULL.,48,1711(2000)
Literature Reference DOI 10.1248/cpb.48.1711
Molecular Weight 612.674 g/mol
Solvent CDCl3
Source File Reference UWVN4666