SpectraBase Compound ID | 8AOvIOOUjZq |
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InChI | InChI=1S/C27H35N5O14P2/c1-15-11-31(26(36)29-24(15)34)22-8-18(33)20(44-22)13-43-48(40,41)46-19-9-23(32-12-16(2)25(35)30-27(32)37)45-21(19)14-42-47(38,39)28-10-17-6-4-3-5-7-17/h3-7,11-12,18-23,33H,8-10,13-14H2,1-2H3,(H,40,41)(H2,28,38,39)(H,29,34,36)(H,30,35,37)/t18-,19-,20+,21+,22+,23+/m0/s1 |
InChIKey | SHLJPHRFZSRINY-ZFPSYYEBSA-N |
Mol Weight | 715.5 g/mol |
Molecular Formula | C27H35N5O14P2 |
Exact Mass | 715.165575 g/mol |
SpectraBase Spectrum ID | JtPmOjToTnc |
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Name | 5'-(5'-N-BENZYLAMIDOPHOSPHORYLDEOXYTHYMID-3-YLOXYPHOSPHORYL)DEOXYTHYMIDINE |
Comments | , SCALE INVERTED (FROM REFERENCE TEXT)! NAME DEFINED (S.T.) |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C27H35N5O14P2 |
InChI | InChI=1S/C27H35N5O14P2/c1-15-11-31(26(36)29-24(15)34)22-8-18(33)20(44-22)13-43-48(40,41)46-19-9-23(32-12-16(2)25(35)30-27(32)37)45-21(19)14-42-47(38,39)28-10-17-6-4-3-5-7-17/h3-7,11-12,18-23,33H,8-10,13-14H2,1-2H3,(H,40,41)(H2,28,38,39)(H,29,34,36)(H,30,35,37)/t18-,19-,20+,21+,22+,23+/m0/s1 |
InChIKey | SHLJPHRFZSRINY-ZFPSYYEBSA-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 | C5H5N pyridine |