LIPID MAPS

Structure Database (LMSD)

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Common Name

Pochonin H

Systematic Name

Synonyms

LM ID

LMPK15030073

Formula

C₁₈H₁₇O₅Cl

Exact Mass

Calculate m/z

348.076453

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Pochonia chlamydosporia (#280754)

Sordariomycetes (#147550)

The search for a hair-growth stimulant: new radicicol analogues as WNT-5A expression inhibitorsPochonia chlamydosporia var. chlamydosporia,
Tetrahedron Letts, 2009

DOI: 10.1016/j.tetlet.2008.10.099

String Representations

InChiKey (Click to copy)

FMTPUVKFUGIZNF-VMZHVLLKSA-N

InChi (Click to copy)

InChI=1S/C18H17ClO5/c1-10-4-2-3-5-11-6-7-12(24-11)8-13-16(18(22)23-10)14(20)9-15(21)17(13)19/h2-3,6-7,9-10,20-21H,4-5,8H2,1H3/b3-2+/t10-/m1/s1

SMILES (Click to copy)

C1(O)=CC(O)=C(Cl)C2CC3=CC=C(CC=CC[C@H](OC(=O)C1=2)C)O3

Other Databases

PubChem CID

102035230

Calculated Physicochemical Properties

Heavy Atoms 24

Rings 3

Aromatic Rings 2

Rotatable Bonds

Van der Waals Molecular Volume 301.76

Topological Polar Surface Area 81.97

Hydrogen Bond Donors 2

Hydrogen Bond Acceptors 5

logP 4.27

Molar Refractivity 89.15

Admin

Created at

7th Jul 2025

Updated at