SpectraBase Compound ID | EDD3hgJxWwZ |
---|---|
InChI | InChI=1S/C64H64O17/c1-2-3-4-5-6-7-8-27-40-72-63-55(79-61(70)47-36-23-13-24-37-47)54(78-60(69)46-34-21-12-22-35-46)52(50(75-63)42-73-57(66)43-28-15-9-16-29-43)81-64-56(80-62(71)48-38-25-14-26-39-48)53(77-59(68)45-32-19-11-20-33-45)51(49(41-65)74-64)76-58(67)44-30-17-10-18-31-44/h2,9-26,28-39,49-56,63-65H,1,3-8,27,40-42H2/t49-,50+,51+,52+,53+,54-,55-,56-,63-,64+/m1/s1 |
InChIKey | YSTKYPBUPBXKPS-CVCINYEISA-N |
Mol Weight | 1105.2 g/mol |
Molecular Formula | C64H64O17 |
Exact Mass | 1104.414351 g/mol |
SpectraBase Spectrum ID | HQxmeQnB8pc |
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Name | DEC-9-ENYL-2,3,6-TRI-O-BENZOYL-4-O-(2,3,4-TRI-O-BENZOYL-beta-D-GALAKTOPYRANOSYL)-alpha-D-MANNOPYRANOSE |
Compound Number | 7 |
Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
InChI | InChI=1S/C64H64O17/c1-2-3-4-5-6-7-8-27-40-72-63-55(79-61(70)47-36-23-13-24-37-47)54(78-60(69)46-34-21-12-22-35-46)52(50(75-63)42-73-57(66)43-28-15-9-16-29-43)81-64-56(80-62(71)48-38-25-14-26-39-48)53(77-59(68)45-32-19-11-20-33-45)51(49(41-65)74-64)76-58(67)44-30-17-10-18-31-44/h2,9-26,28-39,49-56,63-65H,1,3-8,27,40-42H2/t49-,50+,51+,52+,53+,54-,55-,56-,63-,64+/m1/s1 |
InChIKey | YSTKYPBUPBXKPS-CVCINYEISA-N |
Literature Reference | A.V.NIKOLAEV,T.J.RUTHERFORD,M.A.J.FERGUSON,J.S.BRIMACOMBE J.CHEM.SOC.PERKIN-1,1977(1995) |
Solvent | Methanol-d4:Chloroform-d |