| SpectraBase Compound ID | 5wAZ8EjjW5y |
|---|---|
| InChI | InChI=1S/C35H46O11/c1-10-18(2)28(39)31(40)44-30-29(43-20(4)36)27(33(7)13-11-25(37)46-32(5,6)23(33)16-26(38)41-9)19(3)35-24(45-35)15-22(34(30,35)8)21-12-14-42-17-21/h11-14,17-18,22-24,27-30,39H,3,10,15-16H2,1-2,4-9H3/t18?,22-,23+,24+,27+,28?,29+,30-,33+,34+,35+/m1/s1 |
| InChIKey | LJHQUAFDGSPXHQ-NNYIRLBHSA-N |
| Mol Weight | 642.7 g/mol |
| Molecular Formula | C35H46O11 |
| Exact Mass | 642.304012 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8HxxcBtVT9j |
|---|---|
| Name | AMOTSANGIN_C |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H46O11 |
| InChI | InChI=1S/C35H46O11/c1-10-18(2)28(39)31(40)44-30-29(43-20(4)36)27(33(7)13-11-25(37)46-32(5,6)23(33)16-26(38)41-9)19(3)35-24(45-35)15-22(34(30,35)8)21-12-14-42-17-21/h11-14,17-18,22-24,27-30,39H,3,10,15-16H2,1-2,4-9H3/t18?,22-,23+,24+,27+,28?,29+,30-,33+,34+,35+/m1/s1 |
| InChIKey | LJHQUAFDGSPXHQ-NNYIRLBHSA-N |
| Literature Reference Author | H.D.CHEN,S.P.YANG,S.G.LIAO,B.ZHANG,Y.WU,J.M.YUE |
| Literature Reference Citation | J.NAT.PROD.,71,93(2008) |
| Literature Reference DOI | 10.1021/np070476x |
| Molecular Weight | 642.744 g/mol |
| Sample ID | 27220 |
| Solvent | CDCl3 |