| SpectraBase Compound ID | JwjicDoe67B |
|---|---|
| InChI | InChI=1S/C65H56O36/c66-21(5-1-19-3-7-28(67)29(68)9-19)11-22(95-65-54(86)47(79)35(74)17-94-65)6-2-20-4-8-36(30(69)10-20)97-63(91)27-15-34(73)46(78)53(85)55(27)96-37-16-26-42(52(84)48(37)80)41-23(12-31(70)45(77)51(41)83)60(88)99-56-38(18-93-59(26)87)98-64(92)58-57(56)100-61(89)24-13-32(71)43(75)49(81)39(24)40-25(62(90)101-58)14-33(72)44(76)50(40)82/h3-4,7-10,12-16,22,35,38,47,54,56-58,64-65,67-86,92H,1-2,5-6,11,17-18H2/t22-,35-,38+,47+,54-,56+,57-,58+,64+,65+/m0/s1 |
| InChIKey | KADUMKDGTUVTMV-KGADCVGWSA-N |
| Mol Weight | 1413.1 g/mol |
| Molecular Formula | C65H56O36 |
| Exact Mass | 1412.255128 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7SL4lsUIgj9 |
|---|---|
| Name | HIRSUNIN;BETA-ANOMER |
| Compound Number | 10 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C65H56O36 |
| InChI | InChI=1S/C65H56O36/c66-21(5-1-19-3-7-28(67)29(68)9-19)11-22(95-65-54(86)47(79)35(74)17-94-65)6-2-20-4-8-36(30(69)10-20)97-63(91)27-15-34(73)46(78)53(85)55(27)96-37-16-26-42(52(84)48(37)80)41-23(12-31(70)45(77)51(41)83)60(88)99-56-38(18-93-59(26)87)98-64(92)58-57(56)100-61(89)24-13-32(71)43(75)49(81)39(24)40-25(62(90)101-58)14-33(72)44(76)50(40)82/h3-4,7-10,12-16,22,35,38,47,54,56-58,64-65,67-86,92H,1-2,5-6,11,17-18H2/t22-,35-,38+,47+,54-,56+,57-,58+,64+,65+/m0/s1 |
| InChIKey | KADUMKDGTUVTMV-KGADCVGWSA-N |
| Literature Reference Author | M.W.LEE,T.TANAKA,G.I.NONAKA,I.NISHIOKA |
| Literature Reference Citation | PHYTOCHEM.,31,967(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)80049-k |
| Molecular Weight | 1413.138 g/mol |
| Solvent | ACETONE-D6:D2O |
| Source File Reference | UWVN4993 |