Oryzalexin E

CAT: 0931-TN8030-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-TN8030-01Size:10 mg

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CAS Number

150943-96-7

Target

Antifungal

Related Pathways

Microbiology/Virology

Bioactivity

Oryzalexin E, a diterpene phytoalexin, is isolated from rice leaves exposed to ultraviolet radiation. It inhibits the germination of Pyricularia oryzae spores, with an effective dose (ED50) of 62.5 ppm.

Smiles

C[C@@]12[C@]3(O)C(=C[C@](C=C)(C)CC3)CC[C@]1(C(C)(C)[C@@H](O)CC2)[H]

Molecular Formula

C20H32O2

Molecular Weight

304.47

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Oryzalexin E

Oryzalexin E is a tricyclic diterpenoid that is ent-sandaracopimaradiene bearing two additional hydroxy substituents at the 3alpha- and 9beta-positions. It has a role as a plant metabolite.

CAS Number	150943-96-7
PubChem CID	86289490
IUPAC Name	(2R,4aR,4bS,7S,10aR)-7-ethenyl-1,1,4a,7-tetramethyl-2,3,4,5,6,9,10,10a-octahydrophenanthrene-2,4b-diol
Molecular Formula	C20H32O2
Molecular Weight	304.5
XLogP	4
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	22
Formal Charge	0
Complexity	520

SMILES

C[C@]1(CC[C@@]2(C(=C1)CC[C@H]3[C@]2(CC[C@H](C3(C)C)O)C)O)C=C

InChI

InChI=1S/C20H32O2/c1-6-18(4)11-12-20(22)14(13-18)7-8-15-17(2,3)16(21)9-10-19(15,20)5/h6,13,15-16,21-22H,1,7-12H2,2-5H3/t15-,16-,18-,19-,20+/m1/s1

InChIKey

RGLTYROISYBKIW-BDUQCRIQSA-N

Chemical Structure

2D Structure

CAS: 150943-96-7

CID: 86289490

Formula: C20H32O2

MW: 304.5

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	304.5
XLogP3	4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	304.240230259
Monoisotopic Mass	304.240230259
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	520
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
TBW00966	oryzalexin A
XO165578	Oryzalexin S
XO165577	Oryzalexin E
RM-P130313-01	Oryzalexin D
TBZ1750	Oryzalexin F

Oryzalexin E

Chemical Information

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