| SpectraBase Compound ID | FaWvP5kValY |
|---|---|
| InChI | InChI=1S/C52H83N11O22/c1-2-3-4-5-6-7-8-9-10-11-35(85-52-45(77)44(76)34(68)24-84-52)43(75)33(67)16-26-17-39(72)59-31(22-64)50(82)63-41(42(74)25-12-14-27(66)15-13-25)51(83)61-28(18-36(53)69)46(78)56-21-40(73)58-29(19-37(54)70)48(80)62-32(23-65)49(81)60-30(20-38(55)71)47(79)57-26/h12-15,26,28-35,41-45,52,64-68,74-77H,2-11,16-24H2,1H3,(H2,53,69)(H2,54,70)(H2,55,71)(H,56,78)(H,57,79)(H,58,73)(H,59,72)(H,60,81)(H,61,83)(H,62,80)(H,63,82)/t26-,28-,29+,30+,31-,32+,33-,34-,35-,41-,42-,43-,44+,45-,52-/m1/s1 |
| InChIKey | IRPZALKPQWMSQP-LRYHREBTSA-N |
| Mol Weight | 1214.3 g/mol |
| Molecular Formula | C52H83N11O22 |
| Exact Mass | 1213.571413 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 | AgiUgChoDtC |
|---|---|
| Name | BURKHOLDINE_1213 |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H83N11O22 |
| InChI | InChI=1S/C52H83N11O22/c1-2-3-4-5-6-7-8-9-10-11-35(85-52-45(77)44(76)34(68)24-84-52)43(75)33(67)16-26-17-39(72)59-31(22-64)50(82)63-41(42(74)25-12-14-27(66)15-13-25)51(83)61-28(18-36(53)69)46(78)56-21-40(73)58-29(19-37(54)70)48(80)62-32(23-65)49(81)60-30(20-38(55)71)47(79)57-26/h12-15,26,28-35,41-45,52,64-68,74-77H,2-11,16-24H2,1H3,(H2,53,69)(H2,54,70)(H2,55,71)(H,56,78)(H,57,79)(H,58,73)(H,59,72)(H,60,81)(H,61,83)(H,62,80)(H,63,82)/t26-,28-,29+,30+,31-,32+,33-,34-,35-,41-,42-,43-,44+,45-,52-/m1/s1 |
| InChIKey | IRPZALKPQWMSQP-LRYHREBTSA-N |
| Literature Reference Author | Z.LIN,J.O.FALKINHAM,K.A.TAWFIK,P.JEFFS,B.BRAY,G.DUBAY,J.E.CO X,E.W.SCHMIDT |
| Literature Reference Citation | J.NAT.PROD.,75,1518(2012) |
| Literature Reference DOI | 10.1021/np300108u |
| Molecular Weight | 1214.292 g/mol |
| Sample ID | 41403 |
| Solvent | DMSO-D6 |