SpectraBase Compound ID | K3l2LP5CXKE |
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InChI | InChI=1S/C28H44O7/c1-7-16(2)24(31)34-17(3)27(32)12-13-28(33)21-9-8-19-14-20(30)10-11-25(19,5)22(21)15-23(26(27,28)6)35-18(4)29/h7,17,19-23,30,32-33H,8-15H2,1-6H3/b16-7+/t17-,19+,20+,21-,22+,23-,25+,26-,27-,28+/m1/s1 |
InChIKey | MPYAKGPFCKGVLY-RACMLYFUSA-N |
Mol Weight | 492.7 g/mol |
Molecular Formula | C28H44O7 |
Exact Mass | 492.308704 g/mol |
SpectraBase Spectrum ID | 7SFLmMTtf6x |
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Name | ISOTOMENTOSIN |
Compound Number | A2 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C28H44O7 |
InChI | InChI=1S/C28H44O7/c1-7-16(2)24(31)34-17(3)27(32)12-13-28(33)21-9-8-19-14-20(30)10-11-25(19,5)22(21)15-23(26(27,28)6)35-18(4)29/h7,17,19-23,30,32-33H,8-15H2,1-6H3/b16-7+/t17-,19+,20+,21-,22+,23-,25+,26-,27-,28+/m1/s1 |
InChIKey | MPYAKGPFCKGVLY-RACMLYFUSA-N |
Literature Reference Author | F.ABE,H.OKABE,T.YAMAUCHI,K.HONDA,N.HAYASHI |
Literature Reference Citation | CHEM.PHARM.BULL.,47,869(1999) |
Literature Reference DOI | 10.1248/cpb.47.869 |
Molecular Weight | 492.653 g/mol |
Solvent | C5D5N |
Source File Reference | UWLU8080 |