Maximowicziol A

CAT: 0931-TN7852-02Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0931-TN7852-02Size:50 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

193153-41-2

Bioactivity

Maximowiczol A is a taxonomic compound that can be isolated from Iberian white birch.

Smiles

OC1=CC=C2C=C1OC3=CC=C(C=C3)CCC(O)CC(O)CC2

Molecular Formula

C19H22O4

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

2-Oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),15,18-hexaene-4,10,12-triol

CAS Number	193153-41-2
PubChem CID	163069074
IUPAC Name	2-oxatricyclo[13.2.2.13,7]icosa-1(17),3,5,7(20),15,18-hexaene-4,10,12-triol
Molecular Formula	C19H22O4
Molecular Weight	314.4
XLogP	2.9
Topological Polar Surface Area	69.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Heavy Atom Count	23
Formal Charge	0
Complexity	353

SMILES

C1CC2=CC=C(C=C2)OC3=C(C=CC(=C3)CCC(CC1O)O)O

InChI

InChI=1S/C19H22O4/c20-15-6-1-13-3-8-17(9-4-13)23-19-11-14(5-10-18(19)22)2-7-16(21)12-15/h3-5,8-11,15-16,20-22H,1-2,6-7,12H2

InChIKey

WMZPWUBGSYJEET-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 193153-41-2

CID: 163069074

Formula: C19H22O4

MW: 314.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	314.4
XLogP3	2.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	0
Exact Mass	314.15180918
Monoisotopic Mass	314.15180918
Topological Polar Surface Area	69.9 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	353
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
GTR19233824-01	Maximowicziol A