| SpectraBase Compound ID | C2BXCasGGMw |
|---|---|
| InChI | InChI=1S/C52H86O22/c1-22(2)24(12-15-53)7-6-23(3)29-17-30(57)35-27-9-8-25-16-26(10-13-51(25,4)28(27)11-14-52(29,35)5)68-49-43(66)45(44(34(20-56)71-49)72-47-41(64)39(62)37(60)32(18-54)69-47)73-50-46(36(59)31(58)21-67-50)74-48-42(65)40(63)38(61)33(19-55)70-48/h9,12,22-23,25-26,28-50,53-66H,6-8,10-11,13-21H2,1-5H3/b24-12-/t23-,25?,26+,28?,29?,30-,31+,32+,33-,34-,35-,36+,37-,38+,39-,40+,41+,42-,43-,44-,45-,46-,47-,48-,49-,50-,51+,52-/m1/s1 |
| InChIKey | FYGYHHOTBQJPPM-XUFFFXSYSA-N |
| Mol Weight | 1063.2 g/mol |
| Molecular Formula | C52H86O22 |
| Exact Mass | 1062.561074 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 | 6Anu7ScNjwi |
|---|---|
| Name | MYCALOSIDE-I |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H86O22 |
| InChI | InChI=1S/C52H86O22/c1-22(2)24(12-15-53)7-6-23(3)29-17-30(57)35-27-9-8-25-16-26(10-13-51(25,4)28(27)11-14-52(29,35)5)68-49-43(66)45(44(34(20-56)71-49)72-47-41(64)39(62)37(60)32(18-54)69-47)73-50-46(36(59)31(58)21-67-50)74-48-42(65)40(63)38(61)33(19-55)70-48/h9,12,22-23,25-26,28-50,53-66H,6-8,10-11,13-21H2,1-5H3/b24-12-/t23-,25?,26+,28?,29?,30-,31+,32+,33-,34-,35-,36+,37-,38+,39-,40+,41+,42-,43-,44-,45-,46-,47-,48-,49-,50-,51+,52-/m1/s1 |
| InChIKey | FYGYHHOTBQJPPM-XUFFFXSYSA-N |
| Literature Reference Author | A.S.ANTONOV,S.S.AFIYATULLOV,A.I.KALINOVSKY,L.P.PONOMARENKO,P .S.DMITRENOK,D.L.AMI |
| Literature Reference Citation | J.NAT.PROD.,66,1082(2003) |
| Literature Reference DOI | 10.1021/np0300030 |
| Molecular Weight | 1063.242 g/mol |
| Solvent | C5D5N:CD3OD=19:1 |
| Source File Reference | UWSP169 |