Euphorbiasteroid

CAT: 0931-T3220-01Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0931-T3220-01Size:2 mg

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CAS Number

28649-59-4

Target

AMPK

Related Pathways

Chromatin/Epigenetic, PI3K/Akt/mTOR signaling

Purity

0.9996

Bioactivity

Euphorbiasteroid (Euphobiasteroid) (25-50 μM) decreased differentiation of 3T3-L1 cells via reduction of intracellular triglyceride (TG) accumulation.

Smiles

C[C@H]1C[C@@]2(OC(C)=O)[C@H]([C@H]1OC(=O)Cc1ccccc1)[C@H](OC(C)=O)[C@]1(CO1)CC[C@H]1[C@@H](\C=C(C)\C2=O)C1(C)C

Molecular Formula

C32H40O8

Molecular Weight

552.66

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Euphorbiasteroid

(1'R,2R,3'E,5'R,7'S,11'S,12'R,13'S,14'S)-1',11'-bis(acetyloxy)-3',6',6',14'-tetramethyl-2'-oxospiro[oxirane-2,10'-tricyclo[10.3.0.0⁵,⁷]pentadecan]-3'-en-13'-yl 2-phenylacetate has been reported in Euphorbia lathyris and Macaranga tanarius with data available.

CAS Number	28649-59-4
PubChem CID	15940183
IUPAC Name	[(1'R,2R,3'E,5'R,7'S,11'S,12'R,13'S,14'S)-1',11'-diacetyloxy-3',6',6',14'-tetramethyl-2'-oxospiro[oxirane-2,10'-tricyclo[10.3.0.05,7]pentadec-3-ene]-13'-yl] 2-phenylacetate
Molecular Formula	C32H40O8
Molecular Weight	552.7
XLogP	4.7
Topological Polar Surface Area	109
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	8
Heavy Atom Count	40
Formal Charge	0
Complexity	1090

SMILES

C[C@H]1C[C@]2([C@H]([C@H]1OC(=O)CC3=CC=CC=C3)[C@@H]([C@@]4(CC[C@H]5[C@H](C5(C)C)/C=C(/C2=O)\C)CO4)OC(=O)C)OC(=O)C

InChI

InChI=1S/C32H40O8/c1-18-14-24-23(30(24,5)6)12-13-31(17-37-31)29(38-20(3)33)26-27(39-25(35)15-22-10-8-7-9-11-22)19(2)16-32(26,28(18)36)40-21(4)34/h7-11,14,19,23-24,26-27,29H,12-13,15-17H2,1-6H3/b18-14+/t19-,23-,24+,26+,27-,29-,31+,32+/m0/s1

InChIKey

SDGDWRYYHQOQOJ-XXMLZKCSSA-N

Chemical Structure

2D Structure

CAS: 28649-59-4

CID: 15940183

Formula: C32H40O8

MW: 552.7

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	552.7
XLogP3	4.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	8
Exact Mass	552.27231823
Monoisotopic Mass	552.27231823
Topological Polar Surface Area	109 Å²
Heavy Atom Count	40
Formal Charge	0
Complexity	1090
Isotope Atom Count	0
Defined Atom Stereocenter Count	8
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
585046	Euphorbiasteroid
371426	Euphorbiasteroid discontinued

Euphorbiasteroid

Chemical Information

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