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Tylopiol B
SpectraBase Compound ID GabJJH7gfOq
InChI InChI=1S/C28H44O3/c1-17(2)18(3)7-8-19(4)22-10-11-23-24-12-9-20-15-21(29)13-14-27(20,5)26(31-24)16-25(30)28(22,23)6/h7-8,12,17-23,26,29H,9-11,13-16H2,1-6H3/b8-7+/t18-,19+,20?,21-,22+,23-,26-,27-,28+/m0/s1
InChIKey XFCWPFNQLVJSCP-HPYBVJLHSA-N
Mol Weight 428.7 g/mol
Molecular Formula C28H44O3
Exact Mass 428.329045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DAZh3MYUo62
Name Tylopiol B
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44O3
InChI InChI=1S/C28H44O3/c1-17(2)18(3)7-8-19(4)22-10-11-23-24-12-9-20-15-21(29)13-14-27(20,5)26(31-24)16-25(30)28(22,23)6/h7-8,12,17-23,26,29H,9-11,13-16H2,1-6H3/b8-7+/t18-,19+,20?,21-,22+,23-,26-,27-,28+/m0/s1
InChIKey XFCWPFNQLVJSCP-HPYBVJLHSA-N
Molecular Weight 428.657 g/mol
SMILES O[C@@]1(CC2CC=C3[C@]4([C@](C(C[C@@]([C@]2(CC1)C)(O3)[H])=O)([C@](CC4)([C@@](\C=C\[C@@](C(C)C)(C)[H])(C)[H])[H])C)[H])[H]
SPLASH splash10-0a4i-0950400000-0358708002f4dd2e56cc
Source of Spectrum G4-63-536-2
Synonyms (1S,2S,5S,11R,14R,15R)-5-hydroxy-2,15-dimethyl-14-[(1R,2E,4R)-1,4,5-trimethyl-2-hexenyl]-18-oxatetracyclo[8.7.1.0(2,7).0(11,15)]octadec-9-en-16-one 3.beta.-Hydroxy-8.alpha.,9.alpha.-oxido-8,9-seco-ergosta-7,22-dien-12-one
Wiley ID 1608346