SpectraBase Compound ID | HlnahFTk0J8 |
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InChI | InChI=1S/C21H36O7/c1-11-5-6-14-12(9-11)13(7-8-21(14,4)26)20(2,3)28-19-18(25)17(24)16(23)15(10-22)27-19/h9,12-19,22-26H,5-8,10H2,1-4H3/t12-,13+,14+,15-,16-,17+,18-,19+,21+/m0/s1 |
InChIKey | SCSWUPTYJNZVPY-FYQWCZPXSA-N |
Mol Weight | 400.5 g/mol |
Molecular Formula | C21H36O7 |
Exact Mass | 400.246103 g/mol |
SpectraBase Spectrum ID | KuSYpL0TI1a |
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Name | PUMILASIDE-C;10-ALPHA,11-DIHYDROXY-CADIN-4-ENE-11-O-BETA-D-GLUCOPYRANOSIDE |
Compound Number | 3 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C21H36O7 |
InChI | InChI=1S/C21H36O7/c1-11-5-6-14-12(9-11)13(7-8-21(14,4)26)20(2,3)28-19-18(25)17(24)16(23)15(10-22)27-19/h9,12-19,22-26H,5-8,10H2,1-4H3/t12-,13+,14+,15-,16-,17+,18-,19+,21+/m0/s1 |
InChIKey | SCSWUPTYJNZVPY-FYQWCZPXSA-N |
Literature Reference Author | J.KITAJIMA,K.KIMIZUKA,Y.TANAKA |
Literature Reference Citation | CHEM.PHARM.BULL.,48,77(2000) |
Literature Reference DOI | 10.1248/cpb.48.77 |
Molecular Weight | 400.513 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU4807 |