| SpectraBase Compound ID | IpR4Ydbn7is |
|---|---|
| InChI | InChI=1S/C61H106O25/c1-8-11-13-14-15-16-19-22-26-30-40(64)81-54-48(72)52(84-61-56(47(71)50(34(5)75-61)80-39(63)10-3)85-57-46(70)44(68)43(67)38(32-62)79-57)35(6)76-59(54)83-51-36(7)77-60-55(49(51)73)82-41(65)31-27-23-20-17-18-21-25-29-37(28-24-12-9-2)78-58-53(86-60)45(69)42(66)33(4)74-58/h33-38,42-62,66-73H,8-32H2,1-7H3/t33-,34-,35+,36+,37?,38-,42-,43-,44+,45+,46-,47+,48-,49-,50-,51+,52+,53-,54-,55-,56+,57+,58+,59+,60+,61-/m1/s1 |
| InChIKey | RYIDWTWUNMIANO-AESPMOMBSA-N |
| Mol Weight | 1239.5 g/mol |
| Molecular Formula | C61H106O25 |
| Exact Mass | 1238.702319 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2XBPhbn0Wkg |
|---|---|
| Name | MURUCIN_2 |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H106O25 |
| InChI | InChI=1S/C61H106O25/c1-8-11-13-14-15-16-19-22-26-30-40(64)81-54-48(72)52(84-61-56(47(71)50(34(5)75-61)80-39(63)10-3)85-57-46(70)44(68)43(67)38(32-62)79-57)35(6)76-59(54)83-51-36(7)77-60-55(49(51)73)82-41(65)31-27-23-20-17-18-21-25-29-37(28-24-12-9-2)78-58-53(86-60)45(69)42(66)33(4)74-58/h33-38,42-62,66-73H,8-32H2,1-7H3/t33-,34-,35+,36+,37?,38-,42-,43-,44+,45+,46-,47+,48-,49-,50-,51+,52+,53-,54-,55-,56+,57+,58+,59+,60+,61-/m1/s1 |
| InChIKey | RYIDWTWUNMIANO-AESPMOMBSA-N |
| Literature Reference Author | I.LEON,R.G.ENRIQUEZ,D.A.NIETO,D.ALONSO,W.F.REYNOLDS,E.ARANDA ,J.VILLA |
| Literature Reference Citation | J.NAT.PROD.,68,1141(2005) |
| Literature Reference DOI | 10.1021/np050075m |
| Molecular Weight | 1239.498 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ12168 |