| SpectraBase Compound ID | HMBItb0due3 |
|---|---|
| InChI | InChI=1S/C38H68O11/c1-25(2)14-10-15-26(3)17-12-23-38(9,46)31(49-35-34(43)33(42)32(41)29(24-39)48-35)20-19-30(47-28(5)40)37(8,45)22-13-18-27(4)16-11-21-36(6,7)44/h14,17-18,29-35,39,41-46H,10-13,15-16,19-24H2,1-9H3/b26-17+,27-18+/t29-,30?,31?,32-,33+,34+,35+,37?,38?/m1/s1 |
| InChIKey | AQZJZMMXWUPXJT-DOLYVOIWSA-N |
| Mol Weight | 701.0 g/mol |
| Molecular Formula | C38H68O11 |
| Exact Mass | 700.476163 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BZ2DfXrobae |
|---|---|
| Name | 14-ACETOXY-22,23-DIHYDRO-15,23-DIHYDROXYIRPEXAN |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H68O11 |
| InChI | InChI=1S/C38H68O11/c1-25(2)14-10-15-26(3)17-12-23-38(9,46)31(49-35-34(43)33(42)32(41)29(24-39)48-35)20-19-30(47-28(5)40)37(8,45)22-13-18-27(4)16-11-21-36(6,7)44/h14,17-18,29-35,39,41-46H,10-13,15-16,19-24H2,1-9H3/b26-17+,27-18+/t29-,30?,31?,32-,33+,34+,35+,37?,38?/m1/s1 |
| InChIKey | AQZJZMMXWUPXJT-DOLYVOIWSA-N |
| Literature Reference Author | S.SILBERBORTH,G.ERKEL,T.ANKE,O.STERNER |
| Literature Reference Citation | J.ANTIBIOTICS,53,1137(2000) |
| Literature Reference DOI | 10.7164/antibiotics.53.1137 |
| Molecular Weight | 700.951 g/mol |
| Solvent | CDCl3 |