| SpectraBase Compound ID | Cw87uUAMBZH |
|---|---|
| InChI | InChI=1S/C47H65N9O11/c1-5-11-38(60)51-35(24-29-12-8-7-9-13-29)43(63)56-40(28(4)57)45(65)54-36(25-30-15-19-32(58)20-16-30)42(62)52-34(14-10-23-50-47(48)49)41(61)53-37(26-31-17-21-33(59)22-18-31)44(64)55-39(46(66)67)27(3)6-2/h7-9,12-13,15-22,27-28,34-37,39-40,57-59H,5-6,10-11,14,23-26H2,1-4H3,(H,51,60)(H,52,62)(H,53,61)(H,54,65)(H,55,64)(H,56,63)(H,66,67)(H4,48,49,50)/t27?,28?,34-,35+,36+,37-,39-,40+/m0/s1 |
| InChIKey | SGZMHCQQOQOYCC-QJHUJPOQSA-N |
| Mol Weight | 932.1 g/mol |
| Molecular Formula | C47H65N9O11 |
| Exact Mass | 931.480354 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BaMqEJesWOD |
|---|---|
| Name | KAHALALIDE_X |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H65N9O11 |
| InChI | InChI=1S/C47H65N9O11/c1-5-11-38(60)51-35(24-29-12-8-7-9-13-29)43(63)56-40(28(4)57)45(65)54-36(25-30-15-19-32(58)20-16-30)42(62)52-34(14-10-23-50-47(48)49)41(61)53-37(26-31-17-21-33(59)22-18-31)44(64)55-39(46(66)67)27(3)6-2/h7-9,12-13,15-22,27-28,34-37,39-40,57-59H,5-6,10-11,14,23-26H2,1-4H3,(H,51,60)(H,52,62)(H,53,61)(H,54,65)(H,55,64)(H,56,63)(H,66,67)(H4,48,49,50)/t27?,28?,34-,35+,36+,37-,39-,40+/m0/s1 |
| InChIKey | SGZMHCQQOQOYCC-QJHUJPOQSA-N |
| Literature Reference Author | K.V.RAO,M.K.NA,J.C.COOK,J.PENG,R.MATSUMOTO,M.T.HAMANN |
| Literature Reference Citation | J.NAT.PROD.,71,772(2008) |
| Literature Reference DOI | 10.1021/np070508g |
| Molecular Weight | 932.087 g/mol |
| Sample ID | 28211 |
| Solvent | DMSO-D6 |