Angeloylgomisin O

CAT: 0931-TN1389Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-TN1389Size:10 mg

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CAS Number

83864-69-1

Target

Others

Related Pathways

Others

Bioactivity

Angeloylgomisin O is a nartural product from Schisandra chinensis.

Smiles

COc1cc2[C@H](OC(=O)C(\C)=C/C)[C@@H](C)[C@@H](C)Cc3cc4OCOc4c(OC)c3-c2c(OC)c1OC

Molecular Formula

C28H34O8

Molecular Weight

498.56

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Angeloylgomisin O

angeloylgomisin o has been reported in Schisandra chinensis with data available.

CAS Number	83864-69-1
PubChem CID	91864462
IUPAC Name	[(8R,9S,10S)-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 Formula	C28H34O8
Molecular Weight	498.6
XLogP	5.8
Topological Polar Surface Area	81.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	7
Heavy Atom Count	36
Formal Charge	0
Complexity	786

SMILES

C/C=C(/C)\C(=O)O[C@@H]1[C@H]([C@H](CC2=CC3=C(C(=C2C4=C(C(=C(C=C14)OC)OC)OC)OC)OCO3)C)C

InChI

InChI=1S/C28H34O8/c1-9-14(2)28(29)36-23-16(4)15(3)10-17-11-20-25(35-13-34-20)26(32-7)21(17)22-18(23)12-19(30-5)24(31-6)27(22)33-8/h9,11-12,15-16,23H,10,13H2,1-8H3/b14-9-/t15-,16-,23+/m0/s1

InChIKey

PLKFSXFJGNZAER-XXDSNBTQSA-N

Chemical Structure

2D Structure

CAS: 83864-69-1

CID: 91864462

Formula: C28H34O8

MW: 498.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	498.6
XLogP3	5.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	7
Exact Mass	498.22536804
Monoisotopic Mass	498.22536804
Topological Polar Surface Area	81.7 Å²
Heavy Atom Count	36
Formal Charge	0
Complexity	786
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
HY-N2209-01	Angeloylgomisin H
AB1895	Angeloylgomisin Q
E8006-1mg	Angeloylgomisin O
MBS5802004	Angeloylgomisin P

Angeloylgomisin O

Chemical Information

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