John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=F3axVZawdlZ SpectraBase Spectrum ID=5BOGnUtNLnK

(accessed ).
BOTOCUDOROL;REL-3-ALPHA,5-ALPHA-DIACETOXY-15-HYDROXY-13-NOR-4-ALPHA-H-BISABOLA-6,7E,9E-TRIEN-2,11-DIONE
SpectraBase Compound ID F3axVZawdlZ
InChI InChI=1S/C18H22O7/c1-10(6-5-7-11(2)20)16-15(24-12(3)21)8-14(9-19)17(23)18(16)25-13(4)22/h5-8,15-16,18-19H,9H2,1-4H3/b7-5+,10-6+/t15-,16+,18-/m1/s1
InChIKey SVSTYUOYKXTMDP-FYMWTKAXSA-N
Mol Weight 350.37 g/mol
Molecular Formula C18H22O7
Exact Mass 350.136553 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5BOGnUtNLnK
Name BOTOCUDOROL;REL-3-ALPHA,5-ALPHA-DIACETOXY-15-HYDROXY-13-NOR-4-ALPHA-H-BISABOLA-6,7E,9E-TRIEN-2,11-DIONE
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O7
InChI InChI=1S/C18H22O7/c1-10(6-5-7-11(2)20)16-15(24-12(3)21)8-14(9-19)17(23)18(16)25-13(4)22/h5-8,15-16,18-19H,9H2,1-4H3/b7-5+,10-6+/t15-,16+,18-/m1/s1
InChIKey SVSTYUOYKXTMDP-FYMWTKAXSA-N
Literature Reference Author R.N.D.ALMEIDA,J.M.BARBOSA-FILHO,V.M.RUMJANEK,R.BRAZ-FILHO
Literature Reference Citation J.BRAZ.CHEM.SOC.,2,71(1991)
Literature Reference DOI 10.5935/0103-5053.19910015
Molecular Weight 350.368 g/mol
Solvent CDCl3
Source File Reference UWLU5602
SpectraBase Batch ID 96VjW8n3Kqg