| SpectraBase Compound ID | HoqSDyuAxm8 |
|---|---|
| InChI | InChI=1S/C60H99NO21/c1-13-15-17-19-21-23-24-25-26-27-28-30-32-34-47(81-59(70)60(10,11)12)46(61-50(69)35-33-31-29-22-20-18-16-14-2)36-73-57-55(77-44(8)67)54(76-43(7)66)52(49(79-57)38-72-40(4)63)82-58-56(78-45(9)68)53(75-42(6)65)51(74-41(5)64)48(80-58)37-71-39(3)62/h32,34,46-49,51-58H,13-31,33,35-38H2,1-12H3,(H,61,69)/b34-32+/t46-,47+,48-,49+,51+,52+,53+,54-,55+,56-,57+,58+/m0/s1 |
| InChIKey | SWNNVZPUVUHRTE-GKDXZIIKSA-N |
| Mol Weight | 1170.4 g/mol |
| Molecular Formula | C60H99NO21 |
| Exact Mass | 1169.670959 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B15r0PlRyTt |
|---|---|
| Name | O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-(1->4)-O-(2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSYL)-(1->1')-(2S,3S,4E)-2-[N-(HEXADECANOYL)-AMIN |
| Compound Number | 6B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H99NO21 |
| InChI | InChI=1S/C60H99NO21/c1-13-15-17-19-21-23-24-25-26-27-28-30-32-34-47(81-59(70)60(10,11)12)46(61-50(69)35-33-31-29-22-20-18-16-14-2)36-73-57-55(77-44(8)67)54(76-43(7)66)52(49(79-57)38-72-40(4)63)82-58-56(78-45(9)68)53(75-42(6)65)51(74-41(5)64)48(80-58)37-71-39(3)62/h32,34,46-49,51-58H,13-31,33,35-38H2,1-12H3,(H,61,69)/b34-32+/t46-,47+,48-,49+,51+,52+,53+,54-,55+,56-,57+,58+/m0/s1 |
| InChIKey | SWNNVZPUVUHRTE-GKDXZIIKSA-N |
| Literature Reference Author | M.A.PETERSON,R.POLT |
| Literature Reference Citation | J.ORG.CHEM.,58,4309(1993) |
| Literature Reference DOI | 10.1021/jo00068a028 |
| Molecular Weight | 1170.440 g/mol |
| Solvent | Unknown |
| Source File Reference | UWSP815 |