Structure database (LMSD)

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LM IDLMPR0104430001
Common NameViscida-4,11(18),14-triene
Systematic Name-
Synonyms-
Exact Mass
272.2504 (neutral)    Calculate m/z:
FormulaC20H32
CategoryPrenol Lipids [PR]
Main ClassIsoprenoids [PR01]
Sub ClassC20 isoprenoids (diterpenes) [PR0104]
Class Level 4Viscidane diterpenoids [PR010443]
PubChem CID42608257
InChIKeyREUUHHGDDCLKJR-HSALFYBXSA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C20H32/c1-15(2)7-6-8-17(4)19-10-9-18(5)20(19)13-11-16(3)12-14-20/h7,11,18-19H,4,6,8-10,12-14H2,1-3,5H3/t18-,19+,20-/m1/s1
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SMILES
C1[C@@]2([C@H](C(CC/C=C(\C)/C)=C)CC[C@H]2C)CCC(C)=C1
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StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms20Rings2Aromatic Rings0Rotatable Bonds4
 van der Waals
Molecular Volume
321.92Topological Polar
Surface Area
0.00Hydrogen
Bond Donors
0Hydrogen
Bond Acceptors
0
 logP6.45Molar
Refractivity
89.73