4-hydroxy-25-desoxyneorollinicin

Modify Date: 2024-02-01 12:07:59

4-hydroxy-25-desoxyneorollinicin Structure
4-hydroxy-25-desoxyneorollinicin structure
Common Name 4-hydroxy-25-desoxyneorollinicin
CAS Number 123805-39-0 Molecular Weight 622.916
Density 1.1±0.1 g/cm3 Boiling Point 745.5±40.0 °C at 760 mmHg
Molecular Formula C37H66O7 Melting Point N/A
MSDS N/A Flash Point 220.3±20.8 °C

 Names

Name 3-{2,13-Dihydroxy-13-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]tridecyl}-5-methyl-2(5H)-furanone
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 745.5±40.0 °C at 760 mmHg
Molecular Formula C37H66O7
Molecular Weight 622.916
Flash Point 220.3±20.8 °C
Exact Mass 622.480835
LogP 7.64
Vapour Pressure 0.0±5.6 mmHg at 25°C
Index of Refraction 1.509
InChIKey MBABCNBNDNGODA-UHFFFAOYSA-N
SMILES CCCCCCCCCCC(O)C1CCC(C2CCC(C(O)CCCCCCCCCCC(O)CC3=CC(C)OC3=O)O2)O1

 Synonyms

2(5H)-Furanone, 3-[2,13-dihydroxy-13-[octahydro-5'-(1-hydroxyundecyl)[2,2'-bifuran]-5-yl]tridecyl]-5-methyl-
2(5H)-Furanone, 3-(2,13-dihydroxy-13-(octahydro-5'-(1-hydroxyundecyl)(2,2'-bifuran)-5-yl)tridecyl)-5-methyl-
3-(2,13-Dihydroxy-13-(octahydro-5'-(1-hydroxyundecyl)(2,2'-bifuran)-5-yl)tridecyl)-5-methyl-2(5H)-furanone
3-{2,13-Dihydroxy-13-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]tridecyl}-5-methyl-2(5H)-furanone
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