John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=6ka85s6waYL SpectraBase Spectrum ID=2VAakmCCVav

(accessed ).
CHILIANTHIN_D
SpectraBase Compound ID 6ka85s6waYL
InChI InChI=1S/C78H102O14/c1-67(2)27-29-75(65(86)87)31-33-77(45(47(75)38-67)14-17-55-71(9)23-21-57(82)69(5,6)53(71)19-25-73(55,77)11)40-90-63(84)44-35-42-13-16-49(79)62-59(42)60(43-36-50(80)51(81)37-52(43)92-62)61(44)64(85)91-41-78-34-32-76(66(88)89)30-28-68(3,4)39-48(76)46(78)15-18-56-72(10)24-22-58(83)70(7,8)54(72)20-26-74(56,78)12/h13-16,35-37,47-48,53-58,79-83H,17-34,38-41H2,1-12H3,(H,86,87)(H,88,89)/t47-,48-,53-,54-,55+,56+,57-,58-,71-,72-,73+,74+,75-,76-,77-,78-/m0/s1
InChIKey GTXOHZIHSXRHCH-SXEUNUEYSA-N
Mol Weight 1263.7 g/mol
Molecular Formula C78H102O14
Exact Mass 1262.726959 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2VAakmCCVav
Name CHILIANTHIN_D
Compound Number 5
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C78H102O14
InChI InChI=1S/C78H102O14/c1-67(2)27-29-75(65(86)87)31-33-77(45(47(75)38-67)14-17-55-71(9)23-21-57(82)69(5,6)53(71)19-25-73(55,77)11)40-90-63(84)44-35-42-13-16-49(79)62-59(42)60(43-36-50(80)51(81)37-52(43)92-62)61(44)64(85)91-41-78-34-32-76(66(88)89)30-28-68(3,4)39-48(76)46(78)15-18-56-72(10)24-22-58(83)70(7,8)54(72)20-26-74(56,78)12/h13-16,35-37,47-48,53-58,79-83H,17-34,38-41H2,1-12H3,(H,86,87)(H,88,89)/t47-,48-,53-,54-,55+,56+,57-,58-,71-,72-,73+,74+,75-,76-,77-,78-/m0/s1
InChIKey GTXOHZIHSXRHCH-SXEUNUEYSA-N
Literature Reference Author Z.H.JIANG,T.TANAKA,I.KOUNO
Literature Reference Citation CHEM.PHARM.BULL.,44,1669(1996)
Literature Reference DOI 10.1248/cpb.44.1669
Molecular Weight 1263.659 g/mol
Solvent CD3OD
Source File Reference UWMZ17263
SpectraBase Batch ID ALadwcDR510