Structure Database (LMSD)

Common Name
C25:3 Highly branched isoprenoid A
Systematic Name
2,6,10,14-tetramethyl-9-(3-methylpent-4-enyl)-pentadeca-2,10E-diene
Synonyms
LM ID
LMPR0105010007
Formula
C25H46
Exact Mass
Calculate m/z
346.35995
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Classification

Category
Main Class
Sub Class
Level 4 Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C25 isoprenoids (sesterterpenes) [PR0105]
Acyclic sesterterpenoids [PR010501]

String Representations

InChiKey (Click to copy)
JDHHFJFXMJUWSN-BUVRLJJBSA-N
InChi (Click to copy)
InChI=1S/C25H46/c1-9-22(6)16-18-25(24(8)15-11-13-21(4)5)19-17-23(7)14-10-12-20(2)3/h9,12,15,21-23,25H,1,10-11,13-14,16-19H2,2-8H3/b24-15+
SMILES (Click to copy)
C(CC/C=C(/C(CCC(C)C=C)CCC(C)CC/C=C(\C)/C)\C)(C)C

Other Databases

PubChem CID
12136213

Calculated Physicochemical Properties

Heavy Atoms 25
Rings 0
Aromatic Rings 0
Rotatable Bonds 14
Van der Waals Molecular Volume 433.14
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 8.75
Molar Refractivity 116.98

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Created at
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Updated at
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