| SpectraBase Compound ID | LJYAIEGycsL |
|---|---|
| InChI | InChI=1S/C39H37N3O15/c43-29-27(17-41-33(47)20-8-2-5-11-23(20)36(51)52)56-39(31(45)30(29)44)57-38-28-18(16-40-32(46)19-7-1-4-10-22(19)35(49)50)15-26(25(28)13-14-55-38)42-34(48)21-9-3-6-12-24(21)37(53)54/h1-15,25-31,38-39,43-45H,16-17H2,(H,40,46)(H,41,47)(H,42,48)(H,49,50)(H,51,52)(H,53,54)/t25-,26-,27-,28+,29-,30+,31-,38-,39+/m0/s1 |
| InChIKey | RNLYMYOOMGRUGB-PDCDDLMCSA-N |
| Mol Weight | 787.7 g/mol |
| Molecular Formula | C39H37N3O15 |
| Exact Mass | 787.222467 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JMk2eVFmiWO |
|---|---|
| Name | (6-R)-6,10,6'-TRIS-(2-CARBOXYBENZOYLAMINO)-2',3',4'-TRI-O-ACETYL-6,10,6'-TRIDEOXYAUCUBIN |
| Compound Number | 14 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H37N3O15 |
| InChI | InChI=1S/C39H37N3O15/c43-29-27(17-41-33(47)20-8-2-5-11-23(20)36(51)52)56-39(31(45)30(29)44)57-38-28-18(16-40-32(46)19-7-1-4-10-22(19)35(49)50)15-26(25(28)13-14-55-38)42-34(48)21-9-3-6-12-24(21)37(53)54/h1-15,25-31,38-39,43-45H,16-17H2,(H,40,46)(H,41,47)(H,42,48)(H,49,50)(H,51,52)(H,53,54)/t25-,26-,27-,28+,29-,30+,31-,38-,39+/m0/s1 |
| InChIKey | RNLYMYOOMGRUGB-PDCDDLMCSA-N |
| Literature Reference Author | V.C.RAKOTONDRAMASY,R.LASCHIAZZA,M.LECSO-BORNET,M.KOCH,F.TILL EQUIN,B.DEGUIN |
| Literature Reference Citation | J.NAT.PROD.,70,19(2007) |
| Literature Reference DOI | 10.1021/np060368v |
| Molecular Weight | 787.734 g/mol |
| Sample ID | 29485 |
| Solvent | D2O |