MONOCTANOIN

Search structure
Trade Names:
Synonyms:
Status: Approved (1985)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: VFU0OU98LO

Structure
InChI Key JFUMHQVCWWFATH-UHFFFAOYSA-N
Smile CCCCCCCC(=O)OCC(CO)OC(=O)CCCCCCC.CCCCCCCC(=O)OCC(O)CO.CCCCCCCCCC(=O)OCC(O)CO
InChI
InChI=1S/C19H36O5.C13H26O4.C11H22O4/c1-3-5-7-9-11-13-18(21)23-16-17(15-20)24-19(22)14-12-10-8-6-4-2;1-2-3-4-5-6-7-8-9-13(16)17-11-12(15)10-14;1-2-3-4-5-6-7-11(14)15-9-10(13)8-12/h17,20H,3-16H2,1-2H3;12,14-15H,2-11H2,1H3;10,12-13H,2-9H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C43H84O13
Molecular Weight 809.13
AlogP None
Hydrogen Bond Acceptor None
Hydrogen Bond Donor None
Number of Rotational Bond None
Polar Surface Area None
Molecular species None
Aromatic Rings None
Heavy Atoms None

Cross References

Resources Reference
CAS NUMBER 502-54-5
ChEMBL CHEMBL3301678
FDA SRS VFU0OU98LO
CAS NUMBER 502-54-5
ChEMBL CHEMBL3304484
FDA SRS VFU0OU98LO
CONTENTS