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TERRESTERONE-A;2-BETA,3-ALPHA-DIHYDROXY-PREGNA-4,7,16-TRIEN-12,20-DIONE;12-DEHYDROSTIZOPHYLLIN
SpectraBase Compound ID 8CgtvAuZ52H
InChI InChI=1S/C21H26O4/c1-11(22)14-6-7-15-13-5-4-12-8-17(23)18(24)10-20(12,2)16(13)9-19(25)21(14,15)3/h5-6,8,15-18,23-24H,4,7,9-10H2,1-3H3/t15-,16-,17-,18-,20-,21+/m0/s1
InChIKey BYQIJKZHMIZGDV-JPRZGNOKSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jd6zWZtY03J
Name TERRESTERONE-A;2-BETA,3-ALPHA-DIHYDROXY-PREGNA-4,7,16-TRIEN-12,20-DIONE;12-DEHYDROSTIZOPHYLLIN
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O4
InChI InChI=1S/C21H26O4/c1-11(22)14-6-7-15-13-5-4-12-8-17(23)18(24)10-20(12,2)16(13)9-19(25)21(14,15)3/h5-6,8,15-18,23-24H,4,7,9-10H2,1-3H3/t15-,16-,17-,18-,20-,21+/m0/s1
InChIKey BYQIJKZHMIZGDV-JPRZGNOKSA-N
Literature Reference Author N.RADULOVIC,D.N.QUANG,T.HASHIMOTO,M.NUKADA,M.TANAKA,Y.ASAKAW A
Literature Reference Citation CHEM.PHARM.BULL.,53,309(2005)
Literature Reference DOI 10.1248/cpb.53.309
Molecular Weight 342.435 g/mol
Sample ID 53906
Solvent CDCl3