ChemComp-HZZ: [(2~{Z})-3,7-dimethylocta-2,6-dienyl] dihydrogen phosphate

Basic information

• Entry: Database: PDB chemical components / ID: HZZ
• Name: Name: [(2~{Z})-3,7-dimethylocta-2,6-dienyl] dihydrogen phosphate; Synonyms: [(2Z)-3,7-dimethylocta-2,6-dienyl] dihydrogen phosphate; (Z)-3,7-Dimethylocta-2,6-dien-1-yl dihydrogen phosphate; Geranyl monophosphate

Chemical information

Composition

Formula: C₁₀H₁₉O₄P / Number of atoms: 34 / Formula weight: 234.229 / Formal charge: 0

Others

6qlv

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: HZZ / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6QLV

History

Create component	Feb 1, 2019
Initial release	Jun 5, 2019
Modify synonyms	Aug 10, 2021

• External links: UniChem / ChemSpider / Brenda / PubChem / Wikipedia search / Google search

Details

SMILES

• CACTVS 3.385: CC(C)=CCCC(C)=CCO[P](O)(O)=O
• OpenEye OEToolkits 2.0.7: CC(=CCCC(=CCOP(=O)(O)O)C)C

SMILES CANONICAL

• CACTVS 3.385: CC(C)=CCC\C(C)=C/CO[P](O)(O)=O
• OpenEye OEToolkits 2.0.7: CC(=CCC/C(=C\COP(=O)(O)O)/C)C

InChI

• InChI 1.03: InChI=1S/C10H19O4P/c1-9(2)5-4-6-10(3)7-8-14-15(11,12)13/h5,7H,4,6,8H2,1-3H3,(H2,11,12,13)/b10-7-

InChIKey

• InChI 1.03: FFOWJDCTFSWUMJ-YFHOEESVSA-N

PDB entries

Showing all 1 items

PDB-6qlv:
Crystal structure of W200H UbiX in complex with a geranyl-FMN N5 adduct