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VATDIOSPYROIDOL

View entire compound with spectra: 1 NMR

VATDIOSPYROIDOL
SpectraBase Compound ID 3n2EZgXXczy
InChI InChI=1S/C56H42O12/c57-31-9-1-25(2-10-31)43-47-39(65)23-41-49(45(29-17-35(61)21-36(62)18-29)55(67-41)27-5-13-33(59)14-6-27)53(47)52-44(26-3-11-32(58)12-4-26)51(43)54-48(52)40(66)24-42-50(54)46(30-19-37(63)22-38(64)20-30)56(68-42)28-7-15-34(60)16-8-28/h1-24,43-46,51-52,55-66H/t43-,44-,45+,46-,51+,52-,55-,56+/m0/s1
InChIKey DTAYOOZOCCYGJM-DOMWLAFOSA-N
Mol Weight 906.9 g/mol
Molecular Formula C56H42O12
Exact Mass 906.267627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GhGyV0TnLMa
Name VATDIOSPYROIDOL
Compound Number 1
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H42O12
InChI InChI=1S/C56H42O12/c57-31-9-1-25(2-10-31)43-47-39(65)23-41-49(45(29-17-35(61)21-36(62)18-29)55(67-41)27-5-13-33(59)14-6-27)53(47)52-44(26-3-11-32(58)12-4-26)51(43)54-48(52)40(66)24-42-50(54)46(30-19-37(63)22-38(64)20-30)56(68-42)28-7-15-34(60)16-8-28/h1-24,43-46,51-52,55-66H/t43-,44-,45+,46-,51+,52-,55-,56+/m0/s1
InChIKey DTAYOOZOCCYGJM-DOMWLAFOSA-N
Literature Reference Author E.K.SEO,H.CHAI,H.L.CONSTANT,T.SANTISUK,V.REUTRAKUL,C.W.W.BEE CHER,N.R.FRANAWORTH,
Literature Reference Citation J.ORG.CHEM.,64,6976(1999)
Literature Reference DOI 10.1021/jo9902087
Molecular Weight 906.942 g/mol
Sample ID 59377
Solvent ACETONE-D6