LIPID MAPS

Structure Database (LMSD)

Download as... MDLMOL SDF CSV TSV PNG SVG

Common Name

Cytochalasin N

Systematic Name

Synonyms

LM ID

LMPK11000034

Formula

C₃₀H₃₉NO₅

Exact Mass

Calculate m/z

493.282824

Status

Curated

Show lipids differing only in stereochemistry/bond geometry

Classification

References

Taxonomy Information

Curated from

NCBI taxonomy class

Reference

Diaporthe longicolla (#54899)

Sordariomycetes (#147550)

Six new 10-pheynl-[11]cytochalasans, cytochalasins N - S from phomopsis SP.,
Tetrahedron, 1989

DOI: 10.1016/S0040-4020(01)83434-7

String Representations

InChiKey (Click to copy)

WFSYATBEJTUDQA-WQNUPBJZSA-N

InChi (Click to copy)

InChI=1S/C30H39NO5/c1-18-10-9-13-23-27(33)20(3)19(2)26-24(16-22-11-7-6-8-12-22)31-28(34)30(23,26)25(36-21(4)32)14-15-29(5,35)17-18/h6-9,11-15,18,23-27,33,35H,10,16-17H2,1-5H3,(H,31,34)/b13-9+,15-14+/t18-,23-,24-,25+,26-,27+,29-,30+/m0/s1

SMILES (Click to copy)

C1(C)=C(C)[C@@H](O)[C@]2([H])C=CC[C@H](C)C[C@@](C)(O)C=C[C@@H](OC(C)=O)[C@@]32C(=O)N[C@@H](CC2C=CC=CC=2)[C@]13[H]

Other Databases

PubChem CID

13892285

Calculated Physicochemical Properties

Heavy Atoms 36

Rings 4

Aromatic Rings 1

Rotatable Bonds 4

Van der Waals Molecular Volume 501.05

Topological Polar Surface Area 95.86

Hydrogen Bond Donors 3

Hydrogen Bond Acceptors 6

logP 5.03

Molar Refractivity 140.77

Admin

Created at

13th Jan 2026

Updated at