| SpectraBase Compound ID | LESsZNteAzP |
|---|---|
| InChI | InChI=1S/C48H82O18.Na/c1-23-38(62-37-20-18-30(54-10)28(6)59-37)25(3)46(9,52)65-39(23)33-16-15-31(60-33)32-17-19-35(61-32)45(8)42(57-13)27(5)48(66-45)24(2)34(55-11)21-29(63-48)22-36-44(7,58-14)41(56-12)26(4)47(53,64-36)40(49)43(50)51;/h23-42,49,52-53H,15-22H2,1-14H3,(H,50,51);/q;+1/p-1/t23-,24+,25+,26+,27-,28-,29-,30+,31+,32+,33+,34+,35-,36+,37+,38-,39-,40?,41+,42-,44+,45-,46-,47?,48+;/m1./s1 |
| InChIKey | OBROZTNUCRYRNA-JTTQPLQRSA-M |
| Mol Weight | 969.1 g/mol |
| Molecular Formula | C48H81NaO18 |
| Exact Mass | 968.53206 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HWlvHqtduRs |
|---|---|
| Name | ANTIBIOTIC-K41 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H81NaO18 |
| InChI | InChI=1S/C48H82O18.Na/c1-23-38(62-37-20-18-30(54-10)28(6)59-37)25(3)46(9,52)65-39(23)33-16-15-31(60-33)32-17-19-35(61-32)45(8)42(57-13)27(5)48(66-45)24(2)34(55-11)21-29(63-48)22-36-44(7,58-14)41(56-12)26(4)47(53,64-36)40(49)43(50)51;/h23-42,49,52-53H,15-22H2,1-14H3,(H,50,51);/q;+1/p-1/t23-,24+,25+,26+,27-,28-,29-,30+,31+,32+,33+,34+,35-,36+,37+,38-,39-,40?,41+,42-,44+,45-,46-,47?,48+;/m1./s1 |
| InChIKey | OBROZTNUCRYRNA-JTTQPLQRSA-M |
| Literature Reference Author | M.HOSHI,K.W.SHIMOTOHNO,T.ENDO,K.FURIHATA,H.SETO |
| Literature Reference Citation | J.ANTIBIOTICS,50,631(1997) |
| Literature Reference DOI | 10.7164/antibiotics.50.631 |
| Molecular Weight | 969.150 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCS24935 |