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Tylopiol A

View entire compound with spectra: 1 MS (GC)

Tylopiol A
SpectraBase Compound ID 2YdiOBphbTd
InChI InChI=1S/C28H44O2/c1-18(2)19(3)7-8-20(4)23-10-11-24-25-12-9-21-17-22(29)13-15-27(21,5)26(30-25)14-16-28(23,24)6/h7-8,12,14,18-24,29H,9-11,13,15-17H2,1-6H3/b8-7+/t19-,20-,21?,22+,23-,24+,27+,28-/m1/s1
InChIKey CINZVIXZRUAXFE-LDSQTYEISA-N
Mol Weight 412.7 g/mol
Molecular Formula C28H44O2
Exact Mass 412.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4QzcAtCz7C2
Name Tylopiol A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44O2
InChI InChI=1S/C28H44O2/c1-18(2)19(3)7-8-20(4)23-10-11-24-25-12-9-21-17-22(29)13-15-27(21,5)26(30-25)14-16-28(23,24)6/h7-8,12,14,18-24,29H,9-11,13,15-17H2,1-6H3/b8-7+/t19-,20-,21?,22+,23-,24+,27+,28-/m1/s1
InChIKey CINZVIXZRUAXFE-LDSQTYEISA-N
Molecular Weight 412.658 g/mol
SMILES O[C@]1(CC[C@@]2(C3=CC[C@]4([C@](C(O3)=CCC2C1)(CC[C@@]4([C@@](\C=C\[C@](C(C)C)(C)[H])(C)[H])[H])[H])C)C)[H]
SPLASH splash10-0a4i-9600000000-d4f88b9fe1f354a7bfcd
Source of Spectrum G4-63-535-1
Synonyms (2S,5S,11R,14R,15R)-2,15-dimethyl-14-[(1R,2E,4S)-1,4,5-trimethyl-2-hexenyl]-18-oxatetracyclo[8.7.1.0(2,7).0(11,15)]octadeca-1(17),9-dien-5-ol 3.beta.-Hydroxy-8.alpha.,9.alpha.-oxido-8,9-seco-ergosta-7,9(11),22-triene
Wiley ID 1608347