| SpectraBase Compound ID | AR4ap2x5T9m |
|---|---|
| InChI | InChI=1S/C69H125ClO24/c1-41(23-19-31-49(76)61(86)59(84)42(2)32-34-51(78)58(83)44(4)37-47(74)28-21-26-45(72)24-20-25-46(73)27-22-29-48(75)40-71)57(82)53(80)38-56-65(90)66(91)67(92)68(93-56)52(79)35-33-43(3)60(85)64(89)55-39-54(81)63(88)69(94-55)62(87)50(77)30-17-15-13-11-9-7-5-6-8-10-12-14-16-18-36-70/h14,16-18,22,27,30,36,41-42,44-69,71-92H,3,5-13,15,19-21,23-26,28-29,31-35,37-40H2,1-2,4H3/b16-14+,27-22+,30-17+,36-18+ |
| InChIKey | XRUGXIHQHGEYPA-OIAFSJPLSA-N |
| Mol Weight | 1374.2 g/mol |
| Molecular Formula | C69H125ClO24 |
| Exact Mass | 1372.824933 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 99857smDBSV |
|---|---|
| Name | 65-(E)-CHLORO-KMTX_1 |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C69H125ClO24 |
| InChI | InChI=1S/C69H125ClO24/c1-41(23-19-31-49(76)61(86)59(84)42(2)32-34-51(78)58(83)44(4)37-47(74)28-21-26-45(72)24-20-25-46(73)27-22-29-48(75)40-71)57(82)53(80)38-56-65(90)66(91)67(92)68(93-56)52(79)35-33-43(3)60(85)64(89)55-39-54(81)63(88)69(94-55)62(87)50(77)30-17-15-13-11-9-7-5-6-8-10-12-14-16-18-36-70/h14,16-18,22,27,30,36,41-42,44-69,71-92H,3,5-13,15,19-21,23-26,28-29,31-35,37-40H2,1-2,4H3/b16-14+,27-22+,30-17+,36-18+ |
| InChIKey | XRUGXIHQHGEYPA-OIAFSJPLSA-N |
| Literature Reference Author | R.M.V.WAGONER,J.R.DEEDS,A.O.TATTERS,A.R.PLACE,C.R.TOMAS,J.L. C.WRIGHT |
| Literature Reference Citation | J.NAT.PROD.,73,1360(2010) |
| Literature Reference DOI | 10.1021/np100158r |
| Molecular Weight | 1374.190 g/mol |
| Sample ID | 36542 |
| Solvent | C5D5N:CD3OD=1:2 |