Schisantherin B

CAT: 0804-HY-N0695-01Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-N0695-01Size:5 mg

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Description

Schisantherin B (Gomisin-B; Wuweizi ester-B; Schisantherin-B) is a natural product.

CAS Number

58546-55-7

Product Name Alternative

Gomisin-B; Wuweizi ester-B; Schisantherin-B

UNSPSC

12352005

Target

Amyloid-β

Type

Natural Products

Related Pathways

Neuronal Signaling

Applications

Neuroscience-Neurodegeneration

Field of Research

Inflammation/Immunology

Assay Protocol

https://www.medchemexpress.com/Schisantherin-B.html

Purity

99.75

Solubility

DMSO : 50 mg/mL (ultrasonic)

Smiles

O=C(OC(C(C)(O)C(C)C1)C2=CC(OC)=C(OC)C(OC)=C2C3=C1C=C4OCOC4=C3OC)/C(C)=C/C

Molecular Formula

C28H34O9

Molecular Weight

514.56

References & Citations

[1]Liu Jiasen, et al. STUDIES ON THE ACTIVE PRINCIPLES OF SCHISANDRA SPHENANTHERA REHD. ET WILS. THE STRUCTURES OF SCHISANTHERIN A, B, C, D, E, AND THE RELATED COMPOUNDS. Science China Mathematics, 1978, (4)

Shipping Conditions

Room Temperature

Storage Conditions

-20°C, 3 years; 4°C, 2 years (Powder)

Scientific Category

Natural Products

Clinical Information

No Development Reported

Chemical Information

Schisantherin B

Gomisin B is a tannin.

CAS Number	58546-55-7
PubChem CID	6438572
IUPAC Name	[(8S,9S,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 Formula	C28H34O9
Molecular Weight	514.6
XLogP	4.6
Topological Polar Surface Area	102
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	7
Heavy Atom Count	37
Formal Charge	0
Complexity	832

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-RZGKOBFOSA-N

Chemical Structure

2D Structure

CAS: 58546-55-7

CID: 6438572

Formula: C28H34O9

MW: 514.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	514.6
XLogP3	4.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	7
Exact Mass	514.22028266
Monoisotopic Mass	514.22028266
Topological Polar Surface Area	102 Å²
Heavy Atom Count	37
Formal Charge	0
Complexity	832
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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HY-123336-01	Schisantherin C
HY-N0860-01	Schisantherin E
HY-N3303	Meliasenin B
HY-W779504-01	B-Cortolone
HY-W127709-01	Chlorophyll b
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Alternative Products

Catalog	Name
N2655-20	Schisantherin A
CS-BS-00270	Schisantherin E

Schisantherin B

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