| SpectraBase Compound ID | Dk1dfuPtThe |
|---|---|
| InChI | InChI=1S/C63H99NO18S/c1-46(28-20-16-12-11-13-17-21-29-47(2)63(77)81-5)62(76)49(4)59(74)37-22-18-14-9-7-6-8-10-15-19-23-38-61(82-83(78,79)80)48(3)60(75)45-58(73)44-55(70)35-26-34-54(69)43-57(72)42-53(68)33-25-32-51(66)40-50(65)30-24-31-52(67)41-56(71)36-27-39-64/h6-11,13-15,17-26,28-30,33,35,37,46,48-59,61-62,65-74,76H,12,16,27,31-32,34,36,38-45,64H2,1-5H3,(H,78,79,80)/b8-6+,9-7+,13-11+,15-10+,18-14+,21-17+,23-19+,28-20+,30-24+,33-25+,35-26+,37-22+,47-29+ |
| InChIKey | HUOIIZNMKHLPEN-CREACGIXSA-N |
| Mol Weight | 1190.5 g/mol |
| Molecular Formula | C63H99NO18S |
| Exact Mass | 1189.658287 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9L9aFR14Vro |
|---|---|
| Name | METHYL_MEDIOMYCIN_A |
| Compound Number | 1B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C63H99NO18S |
| InChI | InChI=1S/C63H99NO18S/c1-46(28-20-16-12-11-13-17-21-29-47(2)63(77)81-5)62(76)49(4)59(74)37-22-18-14-9-7-6-8-10-15-19-23-38-61(82-83(78,79)80)48(3)60(75)45-58(73)44-55(70)35-26-34-54(69)43-57(72)42-53(68)33-25-32-51(66)40-50(65)30-24-31-52(67)41-56(71)36-27-39-64/h6-11,13-15,17-26,28-30,33,35,37,46,48-59,61-62,65-74,76H,12,16,27,31-32,34,36,38-45,64H2,1-5H3,(H,78,79,80)/b8-6+,9-7+,13-11+,15-10+,18-14+,21-17+,23-19+,28-20+,30-24+,33-25+,35-26+,37-22+,47-29+ |
| InChIKey | HUOIIZNMKHLPEN-CREACGIXSA-N |
| Literature Reference Author | P.CAI,F.KONG,P.FINK,M.E.RUPPEN,R.T.WILLIAMSON,T.KEIKO |
| Literature Reference Citation | J.NAT.PROD.,70,215(2007) |
| Literature Reference DOI | 10.1021/np060542f |
| Molecular Weight | 1190.535 g/mol |
| Sample ID | 29624 |
| Solvent | CD3OD |