SpectraBase Compound ID | 19S7YJmu3s7 |
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InChI | InChI=1S/C29H38O9/c1-15-11-28(33)24(32)37-22-12-27(14-30)17(10-21(22)38-25(28)36-15)3-4-20-19(27)5-7-26(2)18(6-8-29(20,26)34)16-9-23(31)35-13-16/h9,14-15,17-22,25,33-34H,3-8,10-13H2,1-2H3/t15-,17+,18-,19+,20-,21-,22-,25+,26-,27-,28+,29+/m1/s1 |
InChIKey | VVJSEPMKQSGCHB-OLEQQPCLSA-N |
Mol Weight | 530.6 g/mol |
Molecular Formula | C29H38O9 |
Exact Mass | 530.251583 g/mol |
SpectraBase Spectrum ID | B46vHXZe0Wn |
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Name | CALACTINOLACTONE |
Compound Number | 20 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C29H38O9 |
InChI | InChI=1S/C29H38O9/c1-15-11-28(33)24(32)37-22-12-27(14-30)17(10-21(22)38-25(28)36-15)3-4-20-19(27)5-7-26(2)18(6-8-29(20,26)34)16-9-23(31)35-13-16/h9,14-15,17-22,25,33-34H,3-8,10-13H2,1-2H3/t15-,17+,18-,19+,20-,21-,22-,25+,26-,27-,28+,29+/m1/s1 |
InChIKey | VVJSEPMKQSGCHB-OLEQQPCLSA-N |
Literature Reference Author | T.WARASHINA,K.SHIKATA,T.MIYASE,S.FUJII,T.NORO |
Literature Reference Citation | CHEM.PHARM.BULL.,56,1159(2008) |
Literature Reference DOI | 10.1248/cpb.56.1159 |
Molecular Weight | 530.615 g/mol |
Sample ID | 2073 |
Solvent | C5D5N |