| SpectraBase Compound ID | 7bQ49jO04TC |
|---|---|
| InChI | InChI=1S/C54H78O27/c1-13-23(7)45(63)69-21-31-33(57)35(59)43(79-51-37(61)41(77-49(67)27(11)17-5)39(29(19-55)71-51)75-47(65)25(9)15-3)53(73-31)81-54-44(36(60)34(58)32(74-54)22-70-46(64)24(8)14-2)80-52-38(62)42(78-50(68)28(12)18-6)40(30(20-56)72-52)76-48(66)26(10)16-4/h13-18,29-44,51-62H,19-22H2,1-12H3/b23-13+,24-14+,25-15+,26-16+,27-17+,28-18+/t29-,30-,31-,32-,33-,34-,35+,36+,37-,38-,39-,40-,41-,42-,43-,44-,51+,52+,53-,54-/m1/s1 |
| InChIKey | BHAUYHDLIURVPC-ZNKXWPPQSA-N |
| Mol Weight | 1159.2 g/mol |
| Molecular Formula | C54H78O27 |
| Exact Mass | 1158.473047 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IW3SIdofCvI |
|---|---|
| Name | ACTINOTETRAOSE-HEXATIGLATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H78O27 |
| InChI | InChI=1S/C54H78O27/c1-13-23(7)45(63)69-21-31-33(57)35(59)43(79-51-37(61)41(77-49(67)27(11)17-5)39(29(19-55)71-51)75-47(65)25(9)15-3)53(73-31)81-54-44(36(60)34(58)32(74-54)22-70-46(64)24(8)14-2)80-52-38(62)42(78-50(68)28(12)18-6)40(30(20-56)72-52)76-48(66)26(10)16-4/h13-18,29-44,51-62H,19-22H2,1-12H3/b23-13+,24-14+,25-15+,26-16+,27-17+,28-18+/t29-,30-,31-,32-,33-,34-,35+,36+,37-,38-,39-,40-,41-,42-,43-,44-,51+,52+,53-,54-/m1/s1 |
| InChIKey | BHAUYHDLIURVPC-ZNKXWPPQSA-N |
| Literature Reference Author | R.W.RICKARDS,J.M.ROTHSCHILD,E.LACEY |
| Literature Reference Citation | J.ANTIBIOTICS,51,1093(1998) |
| Literature Reference DOI | 10.7164/antibiotics.51.1093 |
| Molecular Weight | 1159.197 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWKP658 |