Structure Database (LMSD)

Common Name
4,4'-Diaponeurosporene
Systematic Name
Synonyms
LM ID
LMPR01070132
Formula
C30H42
Exact Mass
Calculate m/z
402.32865
Status
Active
Show lipids differing only in stereochemistry/bond geometry

Main

Classification

Category
Main Class
Sub Class
Prenol Lipids [PR]
Isoprenoids [PR01]
C40 isoprenoids (tetraterpenes) [PR0107]

String Representations

InChiKey (Click to copy)
FPSYVUBUILNSRF-MQMKOTMBSA-N
InChi (Click to copy)
InChI=1S/C30H42/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h9-11,13-19,21-24H,12,20H2,1-8H3/b10-9+,19-11+,21-13+,22-14+,27-17+,28-18+,29-23+,30-24+
SMILES (Click to copy)
C/C(=C/CC/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(/C=C/C=C(/C)\C)\C)/C)/C)/C

References

Other Databases

KEGG ID
C16145
CHEBI ID
62743
LIPIDBANK ID
VCA1050
PubChem CID
6443791
Carotenoid ID
CA00002
PDB ID
C4D

Calculated Physicochemical Properties

Heavy Atoms 30
Rings 0
Aromatic Rings 0
Rotatable Bonds 11
Van der Waals Molecular Volume 501.16
Topological Polar Surface Area 0.00
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
logP 9.71
Molar Refractivity 139.68

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Created at
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Updated at
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