| SpectraBase Compound ID | BkS7Ey62tOG |
|---|---|
| InChI | InChI=1S/C30H40O20/c1-11(31)40-10-20-21(41-12(2)32)22(42-13(3)33)29(48-19(9)39)30(49-20)50-28-26(46-17(7)37)24(44-15(5)35)23(43-14(4)34)25(45-16(6)36)27(28)47-18(8)38/h20-30H,10H2,1-9H3/t20-,21-,22+,23-,24+,25-,26-,27+,28+,29+,30-/m1/s1 |
| InChIKey | XMGKZCMRWNWBPI-MSVLSMSJSA-N |
| Mol Weight | 720.6 g/mol |
| Molecular Formula | C30H40O20 |
| Exact Mass | 720.211294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CIQKuzPs2Qp |
|---|---|
| Name | PERACETYLATED_5-O-(ALPHA-MANNOSYL)-MYO-INOSITOL |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H40O20 |
| InChI | InChI=1S/C30H40O20/c1-11(31)40-10-20-21(41-12(2)32)22(42-13(3)33)29(48-19(9)39)30(49-20)50-28-26(46-17(7)37)24(44-15(5)35)23(43-14(4)34)25(45-16(6)36)27(28)47-18(8)38/h20-30H,10H2,1-9H3/t20-,21-,22+,23-,24+,25-,26-,27+,28+,29+,30-/m1/s1 |
| InChIKey | XMGKZCMRWNWBPI-MSVLSMSJSA-N |
| Literature Reference Author | S.POSPISIL,P.SEDMERA,P.HALADA,M.PETRICEK |
| Literature Reference Citation | J.NAT.PROD.,70,768(2007) |
| Literature Reference DOI | 10.1021/np0606188 |
| Molecular Weight | 720.636 g/mol |
| Sample ID | 30248 |
| Solvent | CDCl3 |