John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=K094gMAbw3y SpectraBase Spectrum ID=1i5iKGmfrcK

(accessed ).
TYROMYCIC-ACID-D;3-OXO-12-BETA-HYDROXYLANOSTA-7,9(11),24(Z)-TRIEN-26-OIC-ACID
SpectraBase Compound ID K094gMAbw3y
InChI InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-13-16-29(6)21-11-12-23-27(3,4)24(31)14-15-28(23,5)22(21)17-25(32)30(20,29)7/h10-11,17-18,20,23,25,32H,8-9,12-16H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,23?,25-,28-,29+,30+/m1/s1
InChIKey MUYQNDWZUCOTJV-XWMBNLATSA-N
Mol Weight 468.7 g/mol
Molecular Formula C30H44O4
Exact Mass 468.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1i5iKGmfrcK
Name TYROMYCIC-ACID-D;3-OXO-12-BETA-HYDROXYLANOSTA-7,9(11),24(Z)-TRIEN-26-OIC-ACID
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H44O4
InChI InChI=1S/C30H44O4/c1-18(9-8-10-19(2)26(33)34)20-13-16-29(6)21-11-12-23-27(3,4)24(31)14-15-28(23,5)22(21)17-25(32)30(20,29)7/h10-11,17-18,20,23,25,32H,8-9,12-16H2,1-7H3,(H,33,34)/b19-10-/t18-,20-,23?,25-,28-,29+,30+/m1/s1
InChIKey MUYQNDWZUCOTJV-XWMBNLATSA-N
Literature Reference Author D.N.QUANG,T.HASHIMOTO,M.TANAKA,S.TAKAOKA,Y.ASAKAWA
Literature Reference Citation J.NAT.PROD.,67,148(2004)
Literature Reference DOI 10.1021/np030264+
Molecular Weight 468.677 g/mol
Solvent CDCl3
Source File Reference UWKP3506
SpectraBase Batch ID Kb2bj0bPltq