| SpectraBase Compound ID | JMmX09VE3C6 |
|---|---|
| InChI | InChI=1S/C65H100N12O21/c1-15-32(5)27-33(6)20-25-44(81)65(12,95)64(94)68-29-46(83)72-48(37(10)78)59(89)70-41(16-2)57(87)73-47(34(7)35(8)54(66)84)58(88)75-50-52(31(3)4)98-63(93)43-19-17-18-26-77(43)62(92)51(53(97-14)39-21-23-40(80)24-22-39)76-60(90)49(38(11)79)74-55(85)36(9)69-45(82)28-67-56(86)42(30-96-13)71-61(50)91/h16,20-25,27,31-32,34-38,42-44,47-53,78-81,95H,15,17-19,26,28-30H2,1-14H3,(H2,66,84)(H,67,86)(H,68,94)(H,69,82)(H,70,89)(H,71,91)(H,72,83)(H,73,87)(H,74,85)(H,75,88)(H,76,90)/b25-20-,33-27+,41-16+/t32?,34-,35+,36-,37+,38-,42+,43-,44?,47-,48+,49+,50+,51?,52-,53?,65?/m0/s1 |
| InChIKey | JHMVDIYMGNHGMP-LIILYDGOSA-N |
| Mol Weight | 1385.6 g/mol |
| Molecular Formula | C65H100N12O21 |
| Exact Mass | 1384.712598 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FoOSOWq4MB9 |
|---|---|
| Name | PAPUAMIDE-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C65H100N12O21 |
| InChI | InChI=1S/C65H100N12O21/c1-15-32(5)27-33(6)20-25-44(81)65(12,95)64(94)68-29-46(83)72-48(37(10)78)59(89)70-41(16-2)57(87)73-47(34(7)35(8)54(66)84)58(88)75-50-52(31(3)4)98-63(93)43-19-17-18-26-77(43)62(92)51(53(97-14)39-21-23-40(80)24-22-39)76-60(90)49(38(11)79)74-55(85)36(9)69-45(82)28-67-56(86)42(30-96-13)71-61(50)91/h16,20-25,27,31-32,34-38,42-44,47-53,78-81,95H,15,17-19,26,28-30H2,1-14H3,(H2,66,84)(H,67,86)(H,68,94)(H,69,82)(H,70,89)(H,71,91)(H,72,83)(H,73,87)(H,74,85)(H,75,88)(H,76,90)/b25-20-,33-27+,41-16+/t32?,34-,35+,36-,37+,38-,42+,43-,44?,47-,48+,49+,50+,51?,52-,53?,65?/m0/s1 |
| InChIKey | JHMVDIYMGNHGMP-LIILYDGOSA-N |
| Literature Reference Author | P.W.FORD,K.R.GUSTAFSON,T.C.MCKEE,N.SHIGEMATSU,L.K.MAURIZI,L. K.PANNELL,D.E.WILLIA |
| Literature Reference Citation | J.AM.CHEM.SOC.,121,5899(1999) |
| Literature Reference DOI | 10.1021/ja990582o |
| Molecular Weight | 1385.577 g/mol |
| Solvent | CD3CN:H2O=4:1 |
| Source File Reference | UWRU11418 |