| SpectraBase Compound ID | Fv2kyC1n4fw |
|---|---|
| InChI | InChI=1S/C70H82O36/c1-33(71)85-27-45-23-25-46(26-24-45)28-89-68-62(104-66(84)48-21-17-14-18-22-48)60(103-65(83)47-19-15-13-16-20-47)54(92-38(6)76)52(100-68)32-90-67-61(96-42(10)80)58(94-40(8)78)55(50(99-67)30-87-35(3)73)105-70-64(98-44(12)82)59(95-41(9)79)56(51(102-70)31-88-36(4)74)106-69-63(97-43(11)81)57(93-39(7)77)53(91-37(5)75)49(101-69)29-86-34(2)72/h13-26,49-64,67-70H,27-32H2,1-12H3/t49-,50+,51+,52-,53+,54+,55+,56-,57+,58-,59-,60+,61+,62-,63-,64+,67+,68-,69-,70-/m0/s1 |
| InChIKey | ATLIBJQFRSKQKJ-GAWIABEFSA-N |
| Mol Weight | 1499.4 g/mol |
| Molecular Formula | C70H82O36 |
| Exact Mass | 1498.458579 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7oIlW8SBQ6Z |
|---|---|
| Name | #11;(4-O-ACETOXYMETHYL)-BENZYL-O-(2,3,4,6-TETRA-O-ACETYL-ALPHA-D-GALACTOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-(1->4)-O-2,3,6-TRI-O-A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C70H82O36 |
| InChI | InChI=1S/C70H82O36/c1-33(71)85-27-45-23-25-46(26-24-45)28-89-68-62(104-66(84)48-21-17-14-18-22-48)60(103-65(83)47-19-15-13-16-20-47)54(92-38(6)76)52(100-68)32-90-67-61(96-42(10)80)58(94-40(8)78)55(50(99-67)30-87-35(3)73)105-70-64(98-44(12)82)59(95-41(9)79)56(51(102-70)31-88-36(4)74)106-69-63(97-43(11)81)57(93-39(7)77)53(91-37(5)75)49(101-69)29-86-34(2)72/h13-26,49-64,67-70H,27-32H2,1-12H3/t49-,50+,51+,52-,53+,54+,55+,56-,57+,58-,59-,60+,61+,62-,63-,64+,67+,68-,69-,70-/m0/s1 |
| InChIKey | ATLIBJQFRSKQKJ-GAWIABEFSA-N |
| Literature Reference Author | F.YAN,M.GILBERT,W.W.WAKARCHUK,J.R.BRISSON,D.M.WHITFIELD |
| Literature Reference Citation | ORG.LETTERS,3,3265(2001) |
| Literature Reference DOI | 10.1021/ol016466j |
| Molecular Weight | 1499.399 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWVN30838 |