| SpectraBase Compound ID | 9Z038bFpWwH |
|---|---|
| InChI | InChI=1S/2C45H46O11/c2*1-22(2)6-5-7-24-16-31(27-12-9-25(46)18-34(27)49)40(44(54)30-14-15-33(48)29(43(30)53)11-8-23(3)4)32(17-24)41-36(51)21-39-42(45(41)55)37(52)20-38(56-39)28-13-10-26(47)19-35(28)50/h2*6,8-10,12-15,17-19,21,31-32,38,40,46-51,53,55H,5,7,11,16,20H2,1-4H3/t2*31-,32-,38?,40-/m11/s1 |
| InChIKey | AZEFUCBUSMHHOX-LGEXELDXSA-N |
| Mol Weight | 1525.7 g/mol |
| Molecular Formula | C90H92O22 |
| Exact Mass | 1524.608025 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IFyAaVoVuko |
|---|---|
| Name | SANGGENOL-M |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C90H92O22 |
| InChI | InChI=1S/2C45H46O11/c2*1-22(2)6-5-7-24-16-31(27-12-9-25(46)18-34(27)49)40(44(54)30-14-15-33(48)29(43(30)53)11-8-23(3)4)32(17-24)41-36(51)21-39-42(45(41)55)37(52)20-38(56-39)28-13-10-26(47)19-35(28)50/h2*6,8-10,12-15,17-19,21,31-32,38,40,46-51,53,55H,5,7,11,16,20H2,1-4H3/t2*31-,32-,38?,40-/m11/s1 |
| InChIKey | AZEFUCBUSMHHOX-LGEXELDXSA-N |
| Literature Reference Author | Y.Q.SHI,T.FUKAI,H.SAKAGAMI,W.J.CHANG,P.Q.YANG,F.P.WANG,T.NOM URA |
| Literature Reference Citation | J.NAT.PROD.,64,181(2001) |
| Literature Reference DOI | 10.1021/np000317c |
| Molecular Weight | 1525.707 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWRU3827 |