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Delectinine
SpectraBase Compound ID 3GzggHdTzU6
InChI InChI=1S/C24H39NO7/c1-5-25-10-21(11-26)7-6-15(31-3)23-13-8-12-14(30-2)9-22(28,16(13)17(12)27)24(29,20(23)25)19(32-4)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12?,13-,14+,15-,16?,17+,18-,19+,20?,21+,22-,23+,24-/m1/s1
InChIKey NCFXPSTWPUGLEA-UFKFNGBFSA-N
Mol Weight 453.6 g/mol
Molecular Formula C24H39NO7
Exact Mass 453.272653 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HbTzaBI7SxA
Name Delectinine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H39NO7
InChI InChI=1S/C24H39NO7/c1-5-25-10-21(11-26)7-6-15(31-3)23-13-8-12-14(30-2)9-22(28,16(13)17(12)27)24(29,20(23)25)19(32-4)18(21)23/h12-20,26-29H,5-11H2,1-4H3/t12?,13-,14+,15-,16?,17+,18-,19+,20?,21+,22-,23+,24-/m1/s1
InChIKey NCFXPSTWPUGLEA-UFKFNGBFSA-N
Molecular Weight 453.576 g/mol
SMILES O[C@@]1(C2[C@]3([C@@]4(C5[C@]6([C@@]2(CC1[C@](C3)(OC)[H])[H])[C@@]([C@](CN5CC)(CC[C@]6(OC)[H])CO)([C@@]4(OC)[H])[H])O)O)[H]
SPLASH splash10-00di-0000900000-489993b8ec24693ff785
Source of Spectrum X4-14-195-0
Synonyms (1beta,6beta,14alpha,16beta)-20-ethyl-4-(hydroxymethyl)-1,6,16-trimethoxyaconitane-7,8,14-triol
Wiley ID 1585187