| SpectraBase Compound ID | 8ZUXnNJJ7lR |
|---|---|
| InChI | InChI=1S/C30H46O6/c1-16-10-13-30(24(34)35)15-14-26(4)17(21(30)29(16,7)36)8-9-19-27(26,5)12-11-18-25(2,3)22(32)20(31)23(33)28(18,19)6/h8,16,18-19,21-23,32-33,36H,9-15H2,1-7H3,(H,34,35)/t16-,18+,19+,21-,22+,23-,26-,27-,28+,29-,30+/m1/s1 |
| InChIKey | VBLIMTVKFVIDFU-PAZRJNPVSA-N |
| Mol Weight | 502.7 g/mol |
| Molecular Formula | C30H46O6 |
| Exact Mass | 502.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6UCJMHbstNz |
|---|---|
| Name | 1-BETA-HYDROXY-2-OXOPOMOLIC-ACID;1-BETA,3-BETA,19-ALPHA-TRIHYDROXY-2-OXOURS-12-EN-28-OIC-ACID |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H46O6 |
| InChI | InChI=1S/C30H46O6/c1-16-10-13-30(24(34)35)15-14-26(4)17(21(30)29(16,7)36)8-9-19-27(26,5)12-11-18-25(2,3)22(32)20(31)23(33)28(18,19)6/h8,16,18-19,21-23,32-33,36H,9-15H2,1-7H3,(H,34,35)/t16-,18+,19+,21-,22+,23-,26-,27-,28+,29-,30+/m1/s1 |
| InChIKey | VBLIMTVKFVIDFU-PAZRJNPVSA-N |
| Literature Reference Author | Y.KASHIWADA,H.K.WANG,T.NAGAO,S.KITANAKA,I.YASUDA,T.FUJIOKA,T .YAMAGISHI,L.M.COSEN |
| Literature Reference Citation | J.NAT.PROD.,61,1090(1998) |
| Literature Reference DOI | 10.1021/np9800710 |
| Molecular Weight | 502.692 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP2111 |