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11-.beta.-(phenylseleno)-3,3-(ethylenedioxy)eudesmano-13,6.alpha.-lactone
SpectraBase Compound ID IBVU6rVAcR7
InChI InChI=1S/C23H30O4Se/c1-15-18-19-17(9-10-21(18,2)11-12-23(15)25-13-14-26-23)22(3,20(24)27-19)28-16-7-5-4-6-8-16/h4-8,15,17-19H,9-14H2,1-3H3/t15?,17-,18-,19+,21+,22-/m1/s1
InChIKey NAVIEJMHJFAPCM-RLGSZRPPSA-N
Mol Weight 449.46 g/mol
Molecular Formula C23H30O4Se
Exact Mass 450.130931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmPtvGvapHo
Name 11-beta-(phenylseleno)-3,3-(ethylenedioxy)eudesmano-13,6.alpha.-lactone
CAS Registry Number 66726-14-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O4Se
InChI InChI=1S/C23H30O4Se/c1-15-18-19-17(9-10-21(18,2)11-12-23(15)25-13-14-26-23)22(3,20(24)27-19)28-16-7-5-4-6-8-16/h4-8,15,17-19H,9-14H2,1-3H3/t15?,17-,18-,19+,21+,22-/m1/s1
InChIKey NAVIEJMHJFAPCM-RLGSZRPPSA-N
Molecular Weight 449.461 g/mol
SMILES [C@]1(C(O[C@]2([C@]1(CC[C@]1(CCC3(C([C@]21[H])C)OCCO3)C)[H])[H])=O)([Se]c1ccccc1)C
SPLASH splash10-0005-9060000000-e8df68727c18514f8835
Source of Spectrum J-52-4794-5
Synonyms (1'S,2'R,5'R,6'R,9'S)-5',9',13'-trimethyl-5'-(phenylselanyl)-3'-oxaspiro[1,3-dioxolane-2,12'-tricyclo[7.4.0.0(2,6)]tridecane]-4'-one 11-.beta.-(phenylseleno)-3,3-(ethylenedioxy)eudesmano-13,6.alpha.-lactone
Wiley ID 1387642