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SpectraBase Compound ID | 4jjqfOJIJW7 |
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InChI | InChI=1S/C21H36O10/c1-10(2)5-16(24)29-9-13-12(6-15(23)21(13,4)28)11(3)8-30-20-19(27)18(26)17(25)14(7-22)31-20/h10,12-15,17-20,22-23,25-28H,3,5-9H2,1-2,4H3/t12-,13+,14+,15+,17+,18-,19+,20+,21+/m1/s1 |
InChIKey | FXNXGISWKWCXRW-QLPIMFLXSA-N |
Mol Weight | 448.5 g/mol |
Molecular Formula | C21H36O10 |
Exact Mass | 448.230847 g/mol |
SpectraBase Spectrum ID | E8GaHq2PQYh |
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Name | PATRINOVALEROSIDATE;1-O-ISOVALEROXYL-11-O-BETA-D-GLUCOPYRANOSYL-JATAMANIN-J |
Compound Number | 3 |
Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C21H36O10 |
InChI | InChI=1S/C21H36O10/c1-10(2)5-16(24)29-9-13-12(6-15(23)21(13,4)28)11(3)8-30-20-19(27)18(26)17(25)14(7-22)31-20/h10,12-15,17-20,22-23,25-28H,3,5-9H2,1-2,4H3/t12-,13+,14+,15+,17+,18-,19+,20+,21+/m1/s1 |
InChIKey | FXNXGISWKWCXRW-QLPIMFLXSA-N |
Literature Reference Author | J.Y.LEE,J.S.KIM,Y.S.KIM,S.S.KANG |
Literature Reference Citation | CHEM.PHARM.BULL.,61,971(2013) |
Literature Reference DOI | 10.1248/cpb.c13-00306 |
Molecular Weight | 448.511 g/mol |
Source File Reference | UWIR4139 |