Products for Research Use Only

Moluccensin V 5mg

CAT: 0628-A16102-5Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0628-A16102-5Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1381946-57-1

Chemical Information

Moluccensin V
CAS Number1381946-57-1
PubChem CID72681182
IUPAC Name[6-(furan-3-yl)-1,5,15-trimethyl-8,18,21-trioxo-7,17-dioxapentacyclo[11.7.1.02,11.05,10.015,20]henicos-11-en-14-yl] acetate
Molecular FormulaC28H32O8
Molecular Weight496.5
XLogP2.3
Topological Polar Surface Area109
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Heavy Atom Count36
Formal Charge0
Complexity1060
SMILES
CC(=O)OC1C2C=C3C(CCC4(C3CC(=O)OC4C5=COC=C5)C)C(C2=O)(C6C1(COC(=O)C6)C)C
InChI
InChI=1S/C28H32O8/c1-14(29)35-25-17-9-16-18(28(4,23(17)32)20-11-21(30)34-13-27(20,25)3)5-7-26(2)19(16)10-22(31)36-24(26)15-6-8-33-12-15/h6,8-9,12,17-20,24-25H,5,7,10-11,13H2,1-4H3
InChIKey
UEHPJZRRCDVJGB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Moluccensin V
CAS: 1381946-57-1
CID: 72681182
Formula: C28H32O8
MW: 496.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight496.5
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count3
Exact Mass496.20971797
Monoisotopic Mass496.20971797
Topological Polar Surface Area109 Ų
Heavy Atom Count36
Formal Charge0
Complexity1060
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count9
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products