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Steviol

View entire compound with spectra: 8 NMR, and 1 MS (GC)

Steviol
SpectraBase Compound ID 1o3S2uk4WNZ
InChI InChI=1S/C20H30O3/c1-13-11-19-9-5-14-17(2,7-4-8-18(14,3)16(21)22)15(19)6-10-20(13,23)12-19/h14-15,23H,1,4-12H2,2-3H3,(H,21,22)/t14-,15-,17+,18+,19+,20-/m0/s1
InChIKey QFVOYBUQQBFCRH-VQSWZGCSSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4E3OBUEvKDs
Name Steviol
Alternate Name(s) (4alpha,5beta)-3-hydroxykaur-16-en-18-oic acid 13-Hydroxykaur-16-en-18-oic acid ent-13-hydroxykaur-16-en-19-oic acid Hydroxydehydrostevic acid Kaur-16-en-18-oic acid, 13-hydroxy- Kaur-16-en-18-oic acid, 13-hydroxy-, (14-.alpha.)- Kaur-16-en-18-oic acid, 13-hydroxy-, (4.alpha.)- Steviol
CAS Registry Number 471-80-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-13-11-19-9-5-14-17(2,7-4-8-18(14,3)16(21)22)15(19)6-10-20(13,23)12-19/h14-15,23H,1,4-12H2,2-3H3,(H,21,22)/t14-,15-,17+,18+,19+,20-/m0/s1
InChIKey QFVOYBUQQBFCRH-VQSWZGCSSA-N
Molecular Weight 318.457 g/mol
SMILES OC([C@]1([C@@]2([C@]([C@]3([C@]4(C[C@@](CC3)(C(C4)=C)O)CC2)[H])(CCC1)C)[H])C)=O
SPLASH splash10-05fr-6912000000-b0e601921d89a66c3516
Source of Spectrum KO-15-214-1
Wiley ID 1318817