![N-HEXADECANOYL-1-O-[ALPHA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL]-(4E)-OCTADECASPHINGENINE](/api/spectrum/3quNwGljdDt/structure.png?h=300&w=458 "N-HEXADECANOYL-1-O-[ALPHA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL]-(4E)-OCTADECASPHINGENINE")
| SpectraBase Compound ID | 404E1ZR0Egi |
|---|---|
| InChI | InChI=1S/C52H97NO18/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(55)35(53-40(56)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-66-50-48(64)45(61)42(58)38(70-50)34-68-52-49(65)46(62)43(59)39(71-52)33-67-51-47(63)44(60)41(57)37(31-54)69-51/h27,29,35-39,41-52,54-55,57-65H,3-26,28,30-34H2,1-2H3,(H,53,56)/b29-27+/t35-,36+,37+,38+,39-,41-,42-,43+,44-,45-,46+,47+,48+,49-,50+,51-,52-/m0/s1 |
| InChIKey | BXLIEUQCBKBVTC-FPDLQMEPSA-N |
| Mol Weight | 1024.3 g/mol |
| Molecular Formula | C52H97NO18 |
| Exact Mass | 1023.670565 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3quNwGljdDt |
|---|---|
| Name | N-HEXADECANOYL-1-O-[ALPHA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL-(1->6)-BETA-D-GALACTOPYRANOSYL]-(4E)-OCTADECASPHINGENINE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H97NO18 |
| InChI | InChI=1S/C52H97NO18/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(55)35(53-40(56)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-66-50-48(64)45(61)42(58)38(70-50)34-68-52-49(65)46(62)43(59)39(71-52)33-67-51-47(63)44(60)41(57)37(31-54)69-51/h27,29,35-39,41-52,54-55,57-65H,3-26,28,30-34H2,1-2H3,(H,53,56)/b29-27+/t35-,36+,37+,38+,39-,41-,42-,43+,44-,45-,46+,47+,48+,49-,50+,51-,52-/m0/s1 |
| InChIKey | BXLIEUQCBKBVTC-FPDLQMEPSA-N |
| Literature Reference Author | N.NODA,R.TANAKA,K.MIYAHARA,T.SUKAMOTO |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,895(1996) |
| Literature Reference DOI | 10.1248/cpb.44.895 |
| Molecular Weight | 1024.338 g/mol |
| Solvent | CDCl3:CD3OD |
| Source File Reference | UWLU31362 |