John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FKjLhhETGgB SpectraBase Spectrum ID=JaU0XE73kno

(accessed ).
17.beta.H-Digitoxigenin
SpectraBase Compound ID FKjLhhETGgB
InChI InChI=1S/C23H34O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23-/m1/s1
InChIKey XZTUSOXSLKTKJQ-XLOYDCNLSA-N
Mol Weight 374.5 g/mol
Molecular Formula C23H34O4
Exact Mass 374.24571 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID JaU0XE73kno
Name 17.beta.H-Digitoxigenin
Alternate Name(s) (3beta,5beta,14alpha)-3,14-dihydroxycard-20(22)-enolide 3-[(3S,5R,8R,9S,10S,13R,14R,17R)-10,13-dimethyl-3,14-bis(oxidanyl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Classification Cardenolides and derivatives
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Formula C23H34O4
InChI InChI=1S/C23H34O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23-/m1/s1
InChIKey XZTUSOXSLKTKJQ-XLOYDCNLSA-N
SPLASH splash10-0udi-0392000000-ca97dfea7bac112a500a
Source of Spectrum F-52-12733-2
SpectraBase Batch ID 4PmcAAf5tRz