Zeylasterone

CAT: 0013-GTR19219166-01Size: 5 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0013-GTR19219166-01Size:5 mg

Selected

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

Quick Request Actions

Description

Zeylasterone is a diterpenoid compound isolated from Celastrus paniculatus. Research indicates it exhibits neuroprotective and anti-inflammatory properties in vitro, making it a candidate for studies in neuroscience and inflammation-related research fields.

CAS Number

78012-25-6

Smiles

C[C@@]12C=3[C@] (C) (C=4C (C (=O) C3) =C (C (O) =O) C (O) =C (O) C4) CC[C@@]1 (C) [C@]5 ([C@@] (C) (CC2) CC[C@] (C (OC) =O) (C) C5) [H]

Molecular Formula

C30H38O7

Molecular Weight

510.62

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Zeylasterone

has anti-bacterial activity; isolated from Maytenus blepharodes; structure in first source

CAS Number	78012-25-6
PubChem CID	13945472
IUPAC Name	(6aS,6bS,8aS,11R,12aR,14aR)-2,3-dihydroxy-11-methoxycarbonyl-6a,6b,8a,11,14a-pentamethyl-5-oxo-7,8,9,10,12,12a,13,14-octahydropicene-4-carboxylic acid
Molecular Formula	C30H38O7
Molecular Weight	510.6
XLogP	6.6
Topological Polar Surface Area	121
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Heavy Atom Count	37
Formal Charge	0
Complexity	1070

SMILES

C[C@]12CC[C@@](C[C@H]1[C@@]3(CC[C@]4(C5=CC(=C(C(=C5C(=O)C=C4[C@]3(CC2)C)C(=O)O)O)O)C)C)(C)C(=O)OC

InChI

InChI=1S/C30H38O7/c1-26-7-8-27(2,25(36)37-6)15-20(26)30(5)12-10-28(3)16-13-18(32)23(33)22(24(34)35)21(16)17(31)14-19(28)29(30,4)11-9-26/h13-14,20,32-33H,7-12,15H2,1-6H3,(H,34,35)/t20-,26-,27-,28+,29-,30+/m1/s1

InChIKey

DXDSZUXZQIKMRQ-GMZGOHOASA-N

Chemical Structure

2D Structure

CAS: 78012-25-6

CID: 13945472

Formula: C30H38O7

MW: 510.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	510.6
XLogP3	6.6
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	510.26175355
Monoisotopic Mass	510.26175355
Topological Polar Surface Area	121 Å²
Heavy Atom Count	37
Formal Charge	0
Complexity	1070
Isotope Atom Count	0
Defined Atom Stereocenter Count	6
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
MBS5822395	Zeylasterone

Zeylasterone

Chemical Information

Alternative Products

Popular Products