Structure database (LMSD)

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LM IDLMPR01070063
Common NameCycloviolaxanthin
Systematic Name-
Synonyms-
Exact Mass
600.4179 (neutral)    Calculate m/z:
FormulaC40H56O4
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC40 isoprenoids (tetraterpenes) [PR0107]
LIPIDBANK IDVCA0061
PubChem CID16061210
InChIKeyRZEVGLVRLUDYEA-AOXVFRMFSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C40H56O4/c1-29(17-13-19-31(3)21-23-39-35(5,6)25-33(43-39)27-37(39,9)41)
15-11-12-16-30(2)18-14-20-32(4)22-24-40-36(7,8)26-34(44-40)28-38(40,10)42/h11-24
,33-34,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,3
1-19+,32-20+/t33-,34-,37+,38+,39+,40+/m0/s1
SMILES-
MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms44Rings4Aromatic Rings0Rotatable Bonds10
 van der Waals
Molecular Volume
662.52Topological Polar
Surface Area
63.06Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
4
 logP10.69Molar
Refractivity
186.29