Structure database (LMSD)

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LM IDLMPR0104540004
Common NameGinkgolide J (W)
Systematic Name-
Synonyms-
Exact Mass
424.1370 (neutral)    Calculate m/z:
FormulaC20H24O10
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC20 isoprenoids (diterpenes) [PR0104]
Class Level 4Ginkgolides and Bilobalides [PR010454]
PubChem CID441296
KEGG IDC07604
InChIKeyLMEHVEUFNRJAAV-OODNYQCMSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C20H24O10/c1-6-12(23)27-7-5-17-11-8(21)9(16(2,3)4)18(17)10(22)13(24)29-
15(18)30-20(17,14(25)28-11)19(6,7)26/h6-11,15,21-22,26H,5H2,1-4H3/t6-,7+,8-,9+,1
0+,11-,15+,17?,18?,19-,20-/m1/s1
SMILES-
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms30Rings6Aromatic Rings0Rotatable Bonds1
 van der Waals
Molecular Volume
360.38Topological Polar
Surface Area
157.10Hydrogen
Bond Donors
3Hydrogen
Bond Acceptors
10
 logP0.64Molar
Refractivity
95.60