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COLOSSOLACTONE-VI;(22R)-3,4-SECO-19,22-DIACETOXY-4-HYDROXYL-LANOSTA-7,9(11),(24Z)-TRIEN-3,26-DIOIC-ACID-3-METHYLESTER
SpectraBase Compound ID LXCgS20wmIj
InChI InChI=1S/C35H52O9/c1-21(31(39)40)10-12-28(44-24(4)37)22(2)25-14-17-34(8)26-11-13-29(32(5,6)41)35(20-43-23(3)36,19-16-30(38)42-9)27(26)15-18-33(25,34)7/h10-11,15,22,25,28-29,41H,12-14,16-20H2,1-9H3,(H,39,40)/b21-10-/t22-,25+,28+,29-,33+,34-,35-/m0/s1
InChIKey IQKAWHUEZWYQHM-SGTCUYSDSA-N
Mol Weight 616.8 g/mol
Molecular Formula C35H52O9
Exact Mass 616.361133 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ES68dwIm2Op
Name COLOSSOLACTONE-VI;(22R)-3,4-SECO-19,22-DIACETOXY-4-HYDROXYL-LANOSTA-7,9(11),(24Z)-TRIEN-3,26-DIOIC-ACID-3-METHYLESTER
Compound Number 305
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H52O9
InChI InChI=1S/C35H52O9/c1-21(31(39)40)10-12-28(44-24(4)37)22(2)25-14-17-34(8)26-11-13-29(32(5,6)41)35(20-43-23(3)36,19-16-30(38)42-9)27(26)15-18-33(25,34)7/h10-11,15,22,25,28-29,41H,12-14,16-20H2,1-9H3,(H,39,40)/b21-10-/t22-,25+,28+,29-,33+,34-,35-/m0/s1
InChIKey IQKAWHUEZWYQHM-SGTCUYSDSA-N
Literature Reference Author Q.XIA,H.ZHANG,X.SUN,H.ZHAO,L.WU,D.ZHU,G.YANG,Y.SHAO,X.ZHANG, X.MAO,L.ZHANG,G.SHE
Literature Reference Citation MOLECULES,19,17478(2014)
Literature Reference DOI 10.3390/molecules191117478
Molecular Weight 616.792 g/mol
Solvent CDCl3
Source File Reference UWLU81950