| SpectraBase Compound ID | B6hx81orsdi |
|---|---|
| InChI | InChI=1S/C53H86O24/c1-21(2)22(3)7-8-24(16-54)28-15-29(58)35-25-9-10-27-36(60)31(12-14-52(27,5)26(25)11-13-53(28,35)6)71-50-44(68)46(45(34(74-50)20-69-23(4)57)75-48-42(66)40(64)38(62)32(17-55)72-48)76-51-47(37(61)30(59)19-70-51)77-49-43(67)41(65)39(63)33(18-56)73-49/h7-8,10,21-22,24-26,28-51,54-56,58-68H,9,11-20H2,1-6H3/b8-7+/t22-,24-,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+,53+/m0/s1 |
| InChIKey | XVNMNJMQUFORCD-OLKBNIJESA-N |
| Mol Weight | 1107.2 g/mol |
| Molecular Formula | C53H86O24 |
| Exact Mass | 1106.550904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JyvYTvGDHxu |
|---|---|
| Name | MYCALOSIDE-D |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H86O24 |
| InChI | InChI=1S/C53H86O24/c1-21(2)22(3)7-8-24(16-54)28-15-29(58)35-25-9-10-27-36(60)31(12-14-52(27,5)26(25)11-13-53(28,35)6)71-50-44(68)46(45(34(74-50)20-69-23(4)57)75-48-42(66)40(64)38(62)32(17-55)72-48)76-51-47(37(61)30(59)19-70-51)77-49-43(67)41(65)39(63)33(18-56)73-49/h7-8,10,21-22,24-26,28-51,54-56,58-68H,9,11-20H2,1-6H3/b8-7+/t22-,24-,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+,53+/m0/s1 |
| InChIKey | XVNMNJMQUFORCD-OLKBNIJESA-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 | 1107.251 g/mol |
| Solvent | C5D5N:CD3OD=19:1 |
| Source File Reference | UWSP164 |