Uvaol

CAT: 0572-TRC-U850180-250MGSize: 250 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0572-TRC-U850180-250MGSize:250 mg

Selected

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

Quick Request Actions

CAS Number

545-46-0

Synonyms

(3β)-Urs-12-ene-3,28-diol; 3,28-Dixydroxyurs-12-ene; 3β,28-Dihydroxyurs-12-ene; Uvalol

Hazard Statement

Not a hazardous substance according to GHS.

Purity

>95% (HPLC)

Smiles

C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C

Molecular Formula

C30 H50 O2

Molecular Weight

442.72

InChI

InChI=1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1

Additionnal Information

IUPAC name: (3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol

Shipping Conditions

Room Temperature

Storage Conditions

-20°C

Chemical Information

Uvaol

Uvaol is a triterpenoid. It has a role as a metabolite.

CAS Number	545-46-0
PubChem CID	92802
IUPAC Name	(3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol
Molecular Formula	C30H50O2
Molecular Weight	442.7
XLogP	7.4
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	32
Formal Charge	0
Complexity	799

SMILES

C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)CO

InChI

InChIKey

XUARCIYIVXVTAE-ZAPOICBTSA-N

Chemical Structure

2D Structure

CAS: 545-46-0

CID: 92802

Formula: C30H50O2

MW: 442.7

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	442.7
XLogP3	7.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	442.381080833
Monoisotopic Mass	442.381080833
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	799
Isotope Atom Count	0
Defined Atom Stereocenter Count	10
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
BA7544-10	Uvaol
GTR19219047-01	Uvaol diacetate

Uvaol

Chemical Information

Alternative Products

Popular Products