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ent-11.alpha.-Acetoxy-7.beta.,14.alpha.-dihydroxy-16-kauren-15-one
SpectraBase Compound ID DuVOYrToYcC
InChI InChI=1S/C22H32O5/c1-11-13-9-14(27-12(2)23)17-21(5)8-6-7-20(3,4)15(21)10-16(24)22(17,18(11)25)19(13)26/h13-17,19,24,26H,1,6-10H2,2-5H3/t13-,14-,15+,16+,17?,19+,21+,22+/m0/s1
InChIKey HLUPECYDMPVTTM-ATJONGSWSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10qnBuGoDo
Name ent-11.alpha.-Acetoxy-7.beta.,14.alpha.-dihydroxy-16-kauren-15-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-11-13-9-14(27-12(2)23)17-21(5)8-6-7-20(3,4)15(21)10-16(24)22(17,18(11)25)19(13)26/h13-17,19,24,26H,1,6-10H2,2-5H3/t13-,14-,15+,16+,17?,19+,21+,22+/m0/s1
InChIKey HLUPECYDMPVTTM-ATJONGSWSA-N
Molecular Weight 376.493 g/mol
SMILES O[C@@]1([C@@]2(C(C([C@]11[C@@](C[C@]3([C@](C1[C@](C2)(OC(=O)C)[H])(CCCC3(C)C)C)[H])(O)[H])=O)=C)[H])[H]
SPLASH splash10-00xr-3913000000-88da01149c313e918000
Source of Spectrum E2-50-813-4
Wiley ID 1555867