Herboxidiene

CAT: 0013-GTR19191174-02Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19191174-02Size:1 mg

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Description

Herboxidiene (GEX1A) is a polyketide natural product derived from Streptomyces with herbicidal, hypocholesterolemic, and anticancer properties. Its anti-angiogenic activity is mediated through the downregulation of VEGFR-2 and HIF-1α, making it a valuable tool for research in oncology and vascular biology, as supported by in vitro studies.

CAS Number

142861-00-5

Field of Research

Cell Biology, Molecular Biology

Smiles

[C@H] ([C@H] ([C@@H] (C) O) OC) (C) [C@@]1 ([C@] (C[C@@H] (/C=C/C=C (\C) /[C@H]2O[C@@H] (CC (O) =O) CC[C@@H]2C) C) (C) O1) [H]

Molecular Formula

C25H42O6

Molecular Weight

438.6

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Herboxidiene

herboxidiene has been reported in Streptomyces chromofuscus with data available.

CAS Number	142861-00-5
PubChem CID	6438496
IUPAC Name	2-[(2R,5S,6S)-6-[(2E,4E,6S)-7-[(2R,3R)-3-[(2R,3R,4R)-4-hydroxy-3-methoxypentan-2-yl]-2-methyloxiran-2-yl]-6-methylhepta-2,4-dien-2-yl]-5-methyloxan-2-yl]acetic acid
Molecular Formula	C25H42O6
Molecular Weight	438.6
XLogP	4.1
Topological Polar Surface Area	88.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	11
Heavy Atom Count	31
Formal Charge	0
Complexity	658

SMILES

C[C@H]1CC[C@@H](O[C@@H]1/C(=C/C=C/[C@@H](C)C[C@@]2([C@H](O2)[C@H](C)[C@H]([C@@H](C)O)OC)C)/C)CC(=O)O

InChI

InChI=1S/C25H42O6/c1-15(14-25(6)24(31-25)18(4)23(29-7)19(5)26)9-8-10-16(2)22-17(3)11-12-20(30-22)13-21(27)28/h8-10,15,17-20,22-24,26H,11-14H2,1-7H3,(H,27,28)/b9-8+,16-10+/t15-,17+,18-,19-,20-,22-,23-,24-,25-/m1/s1

InChIKey

ISZXEMUWHQLLTC-LSIVYLFASA-N

Chemical Structure

2D Structure

CAS: 142861-00-5

CID: 6438496

Formula: C25H42O6

MW: 438.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	438.6
XLogP3	4.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	11
Exact Mass	438.29813906
Monoisotopic Mass	438.29813906
Topological Polar Surface Area	88.5 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	658
Isotope Atom Count	0
Defined Atom Stereocenter Count	9
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
ENZ-CHM487-0005	Herboxidiene

Herboxidiene

Chemical Information

Alternative Products

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