all-trans-octaprenyl diphosphate (CHEBI:16275)

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CHEBI:16275 - all-trans-octaprenyl diphosphate

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ChEBI Name	all-trans-octaprenyl diphosphate

ChEBI ID	CHEBI:16275

ChEBI ASCII Name	all-trans-octaprenyl diphosphate

Definition	An all-trans-polyprenyl diphosphate composed from eight isoprenyl units.

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:12781, CHEBI:44585, CHEBI:10194, CHEBI:22346

Supplier Information	ZINC000008215691

Download	Molfile XML SDF

more structures >>

Molfile

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M END): 21 ms

reading 117 atoms

ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false

1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.

Default Van der Waals type for model set to Babel

117 atoms created

ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation

Script completed

Jmol script terminated

Molfile expand

Formula

C40H68O7P2

Net Charge

Average Mass

722.91120

Monoisotopic Mass

722.44403

InChI

InChI=1S/C40H68O7P2/c1-33(2)17-10-18-34(3)19-11-20-35(4)21-12-22-36(5)23-13-24-37(6)25-14-26-38(7)27-15-28-39(8)29-16-30-40(9)31-32-46-49(44,45)47-48(41,42)43/h17,19,21,23,25,27,29,31H,10-16,18,20,22,24,26,28,30,32H2,1-9H3,(H,44,45)(H2,41,42,43)/b34-19+,35-21+,36-23+,37-25+,38-27+,39-29+,40-31+

InChIKey

IKKLDISSULFFQO-DJMILUHSSA-N

SMILES

CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\CC\C(C)=C\COP(O)(=O)OP(O)(O)=O

Metabolite of Species	Details
Escherichia coli (NCBI:txid562)	See: PubMed

Roles Classification
Biological Role(s):	Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). (via octaprenyl diphosphate )

View more via ChEBI Ontology

ChEBI Ontology
Outgoing	all-trans-octaprenyl diphosphate (CHEBI:16275) has role Escherichia coli metabolite (CHEBI:76971) all-trans-octaprenyl diphosphate (CHEBI:16275) is a all-trans-polyprenyl diphosphate (CHEBI:55337) all-trans-octaprenyl diphosphate (CHEBI:16275) is a octaprenyl diphosphate (CHEBI:53045) all-trans-octaprenyl diphosphate (CHEBI:16275) is conjugate acid of all-trans-octaprenyl diphosphate(3−) (CHEBI:57711)

Incoming	all-trans-octaprenyl diphosphate(3−) (CHEBI:57711) is conjugate base of all-trans-octaprenyl diphosphate (CHEBI:16275)

IUPAC Name

(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl trihydrogen diphosphate

Synonyms	Sources
(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-2,6,10,14,18,22,26,30-OCTAENYL TRIHYDROGEN DIPHOSPHATE	PDBeChem
all-trans-Octaprenyl diphosphate	KEGG COMPOUND
all-trans-octaprenyl pyrophosphate	ChEBI
Farnesylfarnesylgeraniol	KEGG COMPOUND

Manual Xrefs	Databases
C04146	KEGG COMPOUND
LMPR01070226	LIPID MAPS
OTP	PDBeChem
View more database links

Last Modified

25 January 2016

CHEBI:16275 - all-trans-octaprenyl diphosphate

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