| SpectraBase Compound ID | DFOubRJiQV9 |
|---|---|
| InChI | InChI=1S/C68H103NO20/c1-15-16-42-17-18-43-25-35(6)58(88-54-30-66(13,78)62(40(11)83-54)69-41(12)70)33(4)23-31(2)45-20-19-44-56(67(45,14)63(75)55-64(76)68(43,29-42)89-65(55)77)32(3)24-34(5)59(44)85-52-27-48(73)60(38(9)81-52)86-53-28-49(84-50-22-21-46(71)36(7)79-50)61(39(10)82-53)87-51-26-47(72)57(74)37(8)80-51/h17-20,23,25,32-34,36-40,42-54,56-62,71-74,76,78H,15-16,21-22,24,26-30H2,1-14H3,(H,69,70)/b31-23-,35-25- |
| InChIKey | HNJKPJNBDVGEDO-KASCBAPZSA-N |
| Mol Weight | 1254.6 g/mol |
| Molecular Formula | C68H103NO20 |
| Exact Mass | 1253.707345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2IP2Rqgdo6q |
|---|---|
| Name | SACCHAROCARCIN_B |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C68H103NO20 |
| InChI | InChI=1S/C68H103NO20/c1-15-16-42-17-18-43-25-35(6)58(88-54-30-66(13,78)62(40(11)83-54)69-41(12)70)33(4)23-31(2)45-20-19-44-56(67(45,14)63(75)55-64(76)68(43,29-42)89-65(55)77)32(3)24-34(5)59(44)85-52-27-48(73)60(38(9)81-52)86-53-28-49(84-50-22-21-46(71)36(7)79-50)61(39(10)82-53)87-51-26-47(72)57(74)37(8)80-51/h17-20,23,25,32-34,36-40,42-54,56-62,71-74,76,78H,15-16,21-22,24,26-30H2,1-14H3,(H,69,70)/b31-23-,35-25- |
| InChIKey | HNJKPJNBDVGEDO-KASCBAPZSA-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 | 1254.561 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ5306 |