| SpectraBase Compound ID | JydBXmodrKG |
|---|---|
| InChI | InChI=1S/C63H110O26/c1-9-11-13-14-15-16-19-22-26-30-41(66)83-55-50(75)52(87-63-57(89-59-48(73)46(71)45(70)40(32-64)82-59)53(44(69)36(6)78-63)85-58(76)33(3)34(4)65)38(8)79-61(55)86-51-37(7)80-62-56(49(51)74)84-42(67)31-27-23-20-17-18-21-25-29-39(28-24-12-10-2)81-60-54(88-62)47(72)43(68)35(5)77-60/h33-40,43-57,59-65,68-75H,9-32H2,1-8H3/t33?,34?,35-,36-,37+,38+,39+,40+,43-,44-,45+,46-,47+,48+,49-,50-,51+,52+,53+,54-,55-,56-,57+,59-,60+,61+,62+,63-/m1/s1 |
| InChIKey | BCELGCYQEHQPFW-HLRQTLMOSA-N |
| Mol Weight | 1283.5 g/mol |
| Molecular Formula | C63H110O26 |
| Exact Mass | 1282.728534 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GxaAll0Pdwd |
|---|---|
| Name | MURUCIN_9 |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C63H110O26 |
| InChI | InChI=1S/C63H110O26/c1-9-11-13-14-15-16-19-22-26-30-41(66)83-55-50(75)52(87-63-57(89-59-48(73)46(71)45(70)40(32-64)82-59)53(44(69)36(6)78-63)85-58(76)33(3)34(4)65)38(8)79-61(55)86-51-37(7)80-62-56(49(51)74)84-42(67)31-27-23-20-17-18-21-25-29-39(28-24-12-10-2)81-60-54(88-62)47(72)43(68)35(5)77-60/h33-40,43-57,59-65,68-75H,9-32H2,1-8H3/t33?,34?,35-,36-,37+,38+,39+,40+,43-,44-,45+,46-,47+,48+,49-,50-,51+,52+,53+,54-,55-,56-,57+,59-,60+,61+,62+,63-/m1/s1 |
| InChIKey | BCELGCYQEHQPFW-HLRQTLMOSA-N |
| Literature Reference Author | I.LEON,G.MIRON,D.ALONSO |
| Literature Reference Citation | J.NAT.PROD.,69,896(2006) |
| Literature Reference DOI | 10.1021/np0600604 |
| Molecular Weight | 1283.551 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ18554 |