| 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 | 1262.726958 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2VAakmCCVav |
|---|---|
| Name | CHILIANTHIN_D |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 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 |