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TRI-O-ACETYL-LUCIDENIC-ACID-C;3-BETA,7-BETA,12-BETA-TRIACETOXY-4,4,14-ALPHA-TRIMETHYL-11,15-DIOXO-5-ALPHA-CHOL-8-EN-24-OIC-ACID
SpectraBase Compound ID 4xn8v3zjbo5
InChI InChI=1S/C33H46O10/c1-16(10-11-25(38)39)20-14-23(37)33(9)26-21(41-17(2)34)15-22-30(5,6)24(42-18(3)35)12-13-31(22,7)27(26)28(40)29(32(20,33)8)43-19(4)36/h16,20-22,24,29H,10-15H2,1-9H3,(H,38,39)/t16-,20-,21+,22+,24+,29-,31+,32+,33+/m1/s1
InChIKey YYFRJPHINRIWFM-QLVFMAEMSA-N
Mol Weight 602.7 g/mol
Molecular Formula C33H46O10
Exact Mass 602.309098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IpUW4tBGLd2
Name TRI-O-ACETYL-LUCIDENIC-ACID-C;3-BETA,7-BETA,12-BETA-TRIACETOXY-4,4,14-ALPHA-TRIMETHYL-11,15-DIOXO-5-ALPHA-CHOL-8-EN-24-OIC-ACID
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H46O10
InChI InChI=1S/C33H46O10/c1-16(10-11-25(38)39)20-14-23(37)33(9)26-21(41-17(2)34)15-22-30(5,6)24(42-18(3)35)12-13-31(22,7)27(26)28(40)29(32(20,33)8)43-19(4)36/h16,20-22,24,29H,10-15H2,1-9H3,(H,38,39)/t16-,20-,21+,22+,24+,29-,31+,32+,33+/m1/s1
InChIKey YYFRJPHINRIWFM-QLVFMAEMSA-N
Literature Reference Author T.NISHITOBA,H.SATO,T.KASAI,H.KAWAGISHI,S.SAKAMURA
Literature Reference Citation AGR.BIOL.CHEM.,49,1793(1985)
Literature Reference DOI 10.1271/bbb1961.49.1793
Molecular Weight 602.722 g/mol
Solvent CDCl3
Source File Reference UWIR8455