| SpectraBase Compound ID | AzMMbQrjpha |
|---|---|
| InChI | InChI=1S/C43H61NO9/c1-11-28-12-13-29-18-25(6)36(52-32-20-41(9,50)37(26(7)51-32)44-27(8)45)24(5)16-21(2)31-15-14-30-34(22(3)17-23(4)35(30)46)42(31,10)38(47)33-39(48)43(29,19-28)53-40(33)49/h12-16,18,22-24,26,28-32,34-37,46,48,50H,11,17,19-20H2,1-10H3,(H,44,45)/b21-16-,25-18- |
| InChIKey | ANTWWYOEGRLREK-DDRPZVQVSA-N |
| Mol Weight | 736.0 g/mol |
| Molecular Formula | C43H61NO9 |
| Exact Mass | 735.434633 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9xGt73FLWv8 |
|---|---|
| Name | AGLYCONE_WITH_E-SUGAR_OF_SACCHAROCARCIN_A |
| Compound Number | 1 0 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H61NO9 |
| InChI | InChI=1S/C43H61NO9/c1-11-28-12-13-29-18-25(6)36(52-32-20-41(9,50)37(26(7)51-32)44-27(8)45)24(5)16-21(2)31-15-14-30-34(22(3)17-23(4)35(30)46)42(31,10)38(47)33-39(48)43(29,19-28)53-40(33)49/h12-16,18,22-24,26,28-32,34-37,46,48,50H,11,17,19-20H2,1-10H3,(H,44,45)/b21-16-,25-18- |
| InChIKey | ANTWWYOEGRLREK-DDRPZVQVSA-N |
| Literature Reference Author | V.R.HEGDE,M.G.PATEL,P.R.DAS,B.PRMANIK,M.S.PUAR |
| Literature Reference Citation | J.ANTIBIOTICS,50,126(1997) |
| Literature Reference DOI | 10.7164/antibiotics.50.126 |
| Molecular Weight | 735.959 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ5313 |