N2-Isobutyryl-5'-O-(4,4'-dimethoxytrityl)-2'-de...
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81741
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML81741 contains the MS mass spectrum of N2-Isobutyryl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyguanosine with the InChIkey...
Source: N2-Isobutyryl-5'-O-(4,4'-dimethoxytrityl)-2'-deoxyguanosine
Chemical Info
InChI | InChI=1S/C35H37N5O7/c1-21(2)32(42)38-34-37-31-30(33(43)39-34)36-20-40(31)29-18-27(41)28(47-29)19-46-35(22-8-6-5-7-9-22,23-10-14-25(44-3)15-11-23)24-12-16-26(45-4)17-13-24/h5-17,20-21,27-29,41H,18-19H2,1-4H3,(H2,37,38,39,42,43)/t27-,28+,29+/m0/s1 |
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SMILES | CC(C)C(=O)NC1=NC2=C(C(=O)N1)N=CN2[C@H]3C[C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O |
InChI Key | RMQXDNUKLIDXOS-ZGIBFIJWSA-N |
Molecular Formula | C35H37N5O7 |
Exact Mass | 639.269 g/mol |
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Additional Information
Field | Value |
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Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
Id | 7c7532dd-9d22-4a3f-ac54-adf1045e9f5d |
Package id | msbnk-washington_state_univ-bml81741 |
Resource type | HTML |
State | active |