Products for Research Use Only

Cytochalasin N

CAT: 0804-HY-N12193-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-N12193-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Cytochalasin N is a cytorelaxin derived from endophytic fungus Phomopsis sp.CIB-109[1].
CAS Number
108050-28-8
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/cytochalasin-n.html
Solubility
10 mM in DMSO
Smiles
C[C@H]1C/C=C/[C@@]2([H])[C@H](O)C(C)=C(C)[C@]3([H])[C@]2(C(N[C@H]3CC4=CC=CC=C4)=O)[C@H](OC(C)=O)/C=C/[C@](C)(O)C1
Molecular Formula
C30H39NO5
Molecular Weight
493.63
References & Citations
[1]Zhan, Feng, et al. Cytochalasins from the endophytic fungus Phomopsissp. cib-109. Chemistry of Natural Compounds. 2013;49 (4) : 696–698.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Cytochalasin Npho

Cytochalasin Npho is a cytochalasan alkaloid.

CAS Number108050-28-8
PubChem CID6442848
IUPAC Name[(3E,9E)-16-benzyl-5,12-dihydroxy-5,7,13,14-tetramethyl-18-oxo-17-azatricyclo[9.7.0.01,15]octadeca-3,9,13-trien-2-yl] acetate
Molecular FormulaC30H39NO5
Molecular Weight493.6
XLogP2.8
Topological Polar Surface Area95.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count36
Formal Charge0
Complexity947
SMILES
CC1C/C=C/C2C(C(=C(C3C2(C(/C=C/C(C1)(C)O)OC(=O)C)C(=O)NC3CC4=CC=CC=C4)C)C)O
InChI
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+
InChIKey
WFSYATBEJTUDQA-BBXOWAOSSA-N
Chemical Structure
2D Structure
2D structure of Cytochalasin Npho
CAS: 108050-28-8
CID: 6442848
Formula: C30H39NO5
MW: 493.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight493.6
XLogP32.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass493.28282334
Monoisotopic Mass493.28282334
Topological Polar Surface Area95.9 Ų
Heavy Atom Count36
Formal Charge0
Complexity947
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count8
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes