| SpectraBase Compound ID | BTQfUuve2Ub |
|---|---|
| InChI | InChI=1S/C43H77N6O13P/c1-13-29(6)38(48(10)42(56)36(27(2)3)45-41(55)37(28(4)5)47(8)9)34(59-11)23-35(53)49-22-14-15-33(49)39(60-12)30(7)40(54)44-21-20-31-16-18-32(19-17-31)61-63(57,58)62-46-43(24-50,25-51)26-52/h16-19,27-30,33-34,36-39,46,50-52H,13-15,20-26H2,1-12H3,(H,44,54)(H,45,55)(H,57,58)/t29-,30+,33-,34+,36-,37-,38-,39+/m0/s1 |
| InChIKey | VQHRENCOLWYEQC-AOKFJOQHSA-N |
| Mol Weight | 917.1 g/mol |
| Molecular Formula | C43H77N6O13P |
| Exact Mass | 916.528624 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4Q99a9HyHZH |
|---|---|
| Name | TRIS_AURISTATIN_TP |
| Compound Number | 3F |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H76N6O13P |
| InChI | InChI=1S/C43H77N6O13P/c1-13-29(6)38(48(10)42(56)36(27(2)3)45-41(55)37(28(4)5)47(8)9)34(59-11)23-35(53)49-22-14-15-33(49)39(60-12)30(7)40(54)44-21-20-31-16-18-32(19-17-31)61-63(57,58)62-46-43(24-50,25-51)26-52/h16-19,27-30,33-34,36-39,46,50-52H,13-15,20-26H2,1-12H3,(H,44,54)(H,45,55)(H,57,58)/t29-,30+,33-,34+,36-,37-,38-,39+/m0/s1 |
| InChIKey | VQHRENCOLWYEQC-AOKFJOQHSA-N |
| Literature Reference Author | G.R.PETTIT,F.HOGAN,S.TOMS |
| Literature Reference Citation | J.NAT.PROD.,74,962(2011) |
| Literature Reference DOI | 10.1021/np1007334 |
| Solvent | CD3OD |
| Source File Reference | UWMZ38055 |