| SpectraBase Compound ID | 5JC0IIXNjow |
|---|---|
| InChI | InChI=1S/C50H80N8O20S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-39(66)52-30-22-36(64)46(70)56-48(72)42-43(67)27(2)24-58(42)50(74)41(35(63)23-38(51)65)55-47(71)40(34(62)19-28-17-18-33(61)37(20-28)78-79(75,76)77)54-45(69)32-21-29(60)25-57(32)49(73)31(26-59)53-44(30)68/h17-18,20,27,29-32,34-36,40-43,46,59-64,67,70H,3-16,19,21-26H2,1-2H3,(H2,51,65)(H,52,66)(H,53,68)(H,54,69)(H,55,71)(H,56,72)(H,75,76,77) |
| InChIKey | JXFZOXKIGUVSTD-UHFFFAOYSA-N |
| Mol Weight | 1145.3 g/mol |
| Molecular Formula | C50H80N8O20S |
| Exact Mass | 1144.520958 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1fMkmpKB0LK |
|---|---|
| Name | FR209602 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H80N8O20S |
| InChI | InChI=1S/C50H80N8O20S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-39(66)52-30-22-36(64)46(70)56-48(72)42-43(67)27(2)24-58(42)50(74)41(35(63)23-38(51)65)55-47(71)40(34(62)19-28-17-18-33(61)37(20-28)78-79(75,76)77)54-45(69)32-21-29(60)25-57(32)49(73)31(26-59)53-44(30)68/h17-18,20,27,29-32,34-36,40-43,46,59-64,67,70H,3-16,19,21-26H2,1-2H3,(H2,51,65)(H,52,66)(H,53,68)(H,54,69)(H,55,71)(H,56,72)(H,75,76,77) |
| InChIKey | JXFZOXKIGUVSTD-UHFFFAOYSA-N |
| Literature Reference Author | R.KANASAKI,K.SAKAMOTO,M.HASHIMOTO,S.TAKASE,Y.TSURUMI,A.FUJIE ,M.HINO,S.HASHIMOTO, |
| Literature Reference Citation | J.ANTIBIOTICS,59,137(2006) |
| Literature Reference DOI | 10.1038/ja.2006.20 |
| Molecular Weight | 1145.287 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMB452 |