| SpectraBase Compound ID | 1A9DqnRCfK3 |
|---|---|
| InChI | InChI=1S/C63H101N2O14P/c1-37(14-13-27-77-80(69,70)71)45-18-20-47-56-49(33-53(74-9)62(45,47)5)60(3)25-23-43(29-41(60)31-51(56)72-7)78-58(67)64-35-39-15-12-16-40(28-39)36-65-59(68)79-44-24-26-61(4)42(30-44)32-52(73-8)57-48-21-19-46(38(2)17-22-55(66)76-11)63(48,6)54(75-10)34-50(57)61/h12,15-16,28,37-38,41-54,56-57H,13-14,17-27,29-36H2,1-11H3,(H,64,67)(H,65,68)(H2,69,70,71)/t37-,38-,41+,42+,43-,44-,45-,46-,47+,48+,49+,50+,51-,52-,53+,54+,56+,57+,60+,61+,62-,63-/m1/s1 |
| InChIKey | TWQWKDAPVMIPRH-UTOHYMALSA-N |
| Mol Weight | 1141.5 g/mol |
| Molecular Formula | C63H101N2O14P |
| Exact Mass | 1140.699043 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DPjs3hXeoPV |
|---|---|
| Name | TWQWKDAPVMIPRH-UTOHYMALSA-N |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C63H99N2O14P |
| InChI | InChI=1S/C63H101N2O14P/c1-37(14-13-27-77-80(69,70)71)45-18-20-47-56-49(33-53(74-9)62(45,47)5)60(3)25-23-43(29-41(60)31-51(56)72-7)78-58(67)64-35-39-15-12-16-40(28-39)36-65-59(68)79-44-24-26-61(4)42(30-44)32-52(73-8)57-48-21-19-46(38(2)17-22-55(66)76-11)63(48,6)54(75-10)34-50(57)61/h12,15-16,28,37-38,41-54,56-57H,13-14,17-27,29-36H2,1-11H3,(H,64,67)(H,65,68)(H2,69,70,71)/t37-,38-,41+,42+,43-,44-,45-,46-,47+,48+,49+,50+,51-,52-,53+,54+,56+,57+,60+,61+,62-,63-/m1/s1 |
| InChIKey | TWQWKDAPVMIPRH-UTOHYMALSA-N |
| Literature Reference Author | C.GOTO,M.YAMAMURA,A.SATAKE,Y.KOBUKE |
| Literature Reference Citation | J.AM.CHEM.SOC.,123,12152(2001) |
| Literature Reference DOI | 10.1021/ja010761h |
| Solvent | CDCl3 |
| Source File Reference | UWSI24139 |