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ZHANKUIC-ACID-A-METHYLESTER;METHYL-4-ALPHA-METHYL-ERGOSTA-8,24(28)-DIEN-3,7,11-TRIONE-26-OATE
SpectraBase Compound ID EcB7vrxACgJ
InChI InChI=1S/C30H42O5/c1-16(18(3)28(34)35-7)8-9-17(2)20-10-11-21-26-24(32)14-22-19(4)23(31)12-13-29(22,5)27(26)25(33)15-30(20,21)6/h17-22H,1,8-15H2,2-7H3/t17-,18?,19+,20-,21+,22?,29+,30-/m1/s1
InChIKey NZJIIJSJLBIJDO-SIEPRCFOSA-N
Mol Weight 482.7 g/mol
Molecular Formula C30H42O5
Exact Mass 482.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5N1OgTMFTZU
Name ZHANKUIC-ACID-A-METHYLESTER;METHYL-4-ALPHA-METHYL-ERGOSTA-8,24(28)-DIEN-3,7,11-TRIONE-26-OATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O5
InChI InChI=1S/C30H42O5/c1-16(18(3)28(34)35-7)8-9-17(2)20-10-11-21-26-24(32)14-22-19(4)23(31)12-13-29(22,5)27(26)25(33)15-30(20,21)6/h17-22H,1,8-15H2,2-7H3/t17-,18?,19+,20-,21+,22?,29+,30-/m1/s1
InChIKey NZJIIJSJLBIJDO-SIEPRCFOSA-N
Literature Reference Author C.H.CHEN,S.W.YANG,Y.C.SHEN
Literature Reference Citation J.NAT.PROD.,58,1655(1995)
Literature Reference DOI 10.1021/np50125a002
Molecular Weight 482.660 g/mol
Solvent CDCl3
Source File Reference UWCS22803