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Angeloylgomisin P

CAT: 0931-T124224-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T124224-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
77881-08-4
Target
Others, HIV Protease, HBV
Related Pathways
Others, Microbiology/Virology, Proteases/Proteasome
Bioactivity
Angeloylgomisin P is a useful organic compound for research related to life sciences. The catalog number is T124224 and the CAS number is 77881-08-4.
Smiles
COc1cc2C(OC(=O)C(\C)=C/C)C(C)(O)C(C)Cc3cc4OCOc4c(OC)c3-c2c(OC)c1OC
Molecular Formula
C28H34O9
Molecular Weight
514.571
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Angeloylgomisin P

Angeloylgomisin P has been reported in Schisandra bicolor, Schisandra sphenanthera, and other organisms with data available.

CAS Number77881-08-4
PubChem CID13844273
IUPAC Name[(8R,9R,10S)-9-hydroxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-8-yl] (Z)-2-methylbut-2-enoate
Molecular FormulaC28H34O9
Molecular Weight514.6
XLogP4.6
Topological Polar Surface Area102
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count37
Formal Charge0
Complexity832
SMILES
C/C=C(/C)\C(=O)O[C@@H]1C2=CC(=C(C(=C2C3=C(C4=C(C=C3C[C@@H]([C@@]1(C)O)C)OCO4)OC)OC)OC)OC
InChI
InChI=1S/C28H34O9/c1-9-14(2)27(29)37-26-17-12-18(31-5)22(32-6)25(34-8)21(17)20-16(10-15(3)28(26,4)30)11-19-23(24(20)33-7)36-13-35-19/h9,11-12,15,26,30H,10,13H2,1-8H3/b14-9-/t15-,26+,28+/m0/s1
InChIKey
BKGUPIVDQHHVMV-ATODGADHSA-N
Chemical Structure
2D Structure
2D structure of Angeloylgomisin P
CAS: 77881-08-4
CID: 13844273
Formula: C28H34O9
MW: 514.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight514.6
XLogP34.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass514.22028266
Monoisotopic Mass514.22028266
Topological Polar Surface Area102 Ų
Heavy Atom Count37
Formal Charge0
Complexity832
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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