| SpectraBase Compound ID | 8StQDeIZN3T |
|---|---|
| InChI | InChI=1S/C61H59N10O13P/c1-38(72)20-29-52(73)83-46-30-50(70-36-66-53-55(62-34-64-57(53)70)68-59(74)39-14-8-5-9-15-39)82-49(46)33-80-85(78-4)84-47-31-51(71-37-67-54-56(63-35-65-58(54)71)69-60(75)40-16-10-6-11-17-40)81-48(47)32-79-61(41-18-12-7-13-19-41,42-21-25-44(76-2)26-22-42)43-23-27-45(77-3)28-24-43/h5-19,21-28,34-37,46-51H,20,29-33H2,1-4H3,(H,62,64,68,74)(H,63,65,69,75)/t46-,47-,48+,49+,50+,51+,85?/m0/s1 |
| InChIKey | DGTUWRAUMCEOFR-DZAVCBAWSA-N |
| Mol Weight | 1171.2 g/mol |
| Molecular Formula | C61H59N10O13P |
| Exact Mass | 1170.400069 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EvW9lTUeHYK |
|---|---|
| Name | 3'-O-LEVULINOYL-5'-O-(5'-DIMETHOXYTRITYL-N-BENZOYLDEOXYADENOSIN-3'-YLOXY(METHOXY)PHOSPHINO)-N-BENZOYLDEOXYADENOSINE (ISOMER MIXTURE) |
| Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C61H59N10O13P |
| InChI | InChI=1S/C61H59N10O13P/c1-38(72)20-29-52(73)83-46-30-50(70-36-66-53-55(62-34-64-57(53)70)68-59(74)39-14-8-5-9-15-39)82-49(46)33-80-85(78-4)84-47-31-51(71-37-67-54-56(63-35-65-58(54)71)69-60(75)40-16-10-6-11-17-40)81-48(47)32-79-61(41-18-12-7-13-19-41,42-21-25-44(76-2)26-22-42)43-23-27-45(77-3)28-24-43/h5-19,21-28,34-37,46-51H,20,29-33H2,1-4H3,(H,62,64,68,74)(H,63,65,69,75)/t46-,47-,48+,49+,50+,51+,85?/m0/s1 |
| InChIKey | DGTUWRAUMCEOFR-DZAVCBAWSA-N |
| Instrument Name | Bruker HX-90 |
| Literature Reference | A.V.LEBEDEV, A.I.REZVUKHIN (REVIEW) (1983) Bioorganich.Khim.(Russ. Lang.): v.9,N2, 149-185. |
| NMR Standard | -H3PO4 85% |
| Observed nucleus | 31P |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
| Solvent | C3D6O acetone-d6 |