KU60648_BTP_M11
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UoB-XB000203
Dataset description:
This MassBank record with Accession MSBNK-UoB-XB000203 contains the MS2 mass spectrum of KU60648_BTP_M11 with the InChIkey YCJXTVMUKTWLCR-UHFFFAOYSA-N.
Source: KU60648_BTP_M11
Chemical Info
InChI | InChI=1S/C20H33N3O13/c1-2-22-3-5-23(6-4-22)18-13(29)9(25)11(27)15(35-18)17(31)21-7-8(24)34-20-14(30)10(26)12(28)16(36-20)19(32)33/h9-16,18,20,25-30H,2-7H2,1H3,(H,21,31)(H,32,33) |
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SMILES | CCN1CCN(C2OC(C(NCC(OC3OC(C(O)=O)C(O)C(O)C3O)=O)=O)C(O)C(O)C2O)CC1 |
InChI Key | YCJXTVMUKTWLCR-UHFFFAOYSA-N |
Molecular Formula | C20H33N3O13 |
Exact Mass | 523.201 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 4.0 International (CC BY 4.0) |
Id | d5df6322-54be-47b4-902e-0a6fb3b1c028 |
Package id | msbnk-uob-xb000203 |
Resource type | HTML |
State | active |