SpectraBase Compound ID | 1BRC5cnlouP |
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InChI | InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+ |
InChIKey | MQZIGYBFDRPAKN-QISQUURKSA-N |
Mol Weight | 596.9 g/mol |
Molecular Formula | C40H52O4 |
Exact Mass | 596.38656 g/mol |
SpectraBase Spectrum ID | 8sv0pHECYja |
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Name | MQZIGYBFDRPAKN-QISQUURKSA-N |
Compound Number | 99 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C40H52O4 |
InChI | InChI=1S/C40H52O4/c1-27(17-13-19-29(3)21-23-33-31(5)37(43)35(41)25-39(33,7)8)15-11-12-16-28(2)18-14-20-30(4)22-24-34-32(6)38(44)36(42)26-40(34,9)10/h11-24,35-36,41-42H,25-26H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,27-15+,28-16+,29-19+,30-20+ |
InChIKey | MQZIGYBFDRPAKN-QISQUURKSA-N |
Literature Reference Author | G.ENGLERT |
Literature Reference Citation | HELV.CHIM.ACTA,58,2367(1975) |
Literature Reference DOI | 10.1002/hlca.19750580817 |
Molecular Weight | 596.850 g/mol |
Solvent | CDCl3 |
Source File Reference | UWCS9551 |