Structure database (LMSD)

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LM IDLMPR0104540001
Common NameGinkgolide A (W)
Systematic Name-
Synonyms-
Exact Mass
408.1420 (neutral)    Calculate m/z:
FormulaC20H24O9
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC20 isoprenoids (diterpenes) [PR0104]
Class Level 4Ginkgolides and Bilobalides [PR010454]
PubChem CID441293
KEGG IDC07601
InChIKeyFPUXKXIZEIDQKW-TVPHMGRTSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C20H24O9/c1-7-12(22)26-10-6-17-9-5-8(16(2,3)4)18(17)11(21)13(23)28-15(1
8)29-20(17,14(24)27-9)19(7,10)25/h7-11,15,21,25H,5-6H2,1-4H3/t7-,8+,9-,10+,11+,1
5+,17?,18?,19-,20-/m1/s1
SMILES-
MS SpectraView MoNA MS spectra     
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms29Rings6Aromatic Rings0Rotatable Bonds1
 van der Waals
Molecular Volume
351.59Topological Polar
Surface Area
136.87Hydrogen
Bond Donors
2Hydrogen
Bond Acceptors
9
 logP1.38Molar
Refractivity
93.69