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ACETIC ACID, 17-[1-HYDROXY-1,5-DIMETHYL-5-(TETRAHYDRO-PYRAN-2-YLOXY)-HEX-2-YNYL]-10,13-DIMETHYL-11-OXO-HEXADECAHYDROCYCLOPENTA[a]PHENANTHREN-2-YL ESTER
SpectraBase Compound ID 38ixzwtX6Q9
InChI InChI=1S/C32H50O4.C2H4O2/c1-29(2,36-27-12-7-9-20-35-27)17-10-19-32(5,34)26-16-15-24-23-14-13-22-11-6-8-18-30(22,3)28(23)25(33)21-31(24,26)4;1-2(3)4/h22-24,26-28,34H,6-9,11-18,20-21H2,1-5H3;1H3,(H,3,4)
InChIKey YKTDYEDZXFGVOK-UHFFFAOYSA-N
Mol Weight 558.8 g/mol
Molecular Formula C34H54O6
Exact Mass 558.392039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 91mf0hCB68r
Name ACETIC ACID, 17-[1-HYDROXY-1,5-DIMETHYL-5-(TETRAHYDRO-PYRAN-2-YLOXY)-HEX-2-YNYL]-10,13-DIMETHYL-11-OXO-HEXADECAHYDROCYCLOPENTA[a]PHENANTHREN-2-YL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C34H52O6
InChI InChI=1S/C32H50O4.C2H4O2/c1-29(2,36-27-12-7-9-20-35-27)17-10-19-32(5,34)26-16-15-24-23-14-13-22-11-6-8-18-30(22,3)28(23)25(33)21-31(24,26)4;1-2(3)4/h22-24,26-28,34H,6-9,11-18,20-21H2,1-5H3;1H3,(H,3,4)
InChIKey YKTDYEDZXFGVOK-UHFFFAOYSA-N
Molecular Weight 558.3906
SMILES OC(C)=O.OC(C)(C#CCC(OC1CCCCO1)(C)C)C1CCC2C1(C)CC(=O)C1C3(CCCCC3CCC21)C
SPLASH splash10-000i-9521000000-1ae10b69e1d0747fa196
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany