1.0 2011-09-21 00:22:45 UTC 2015-07-21 06:57:27 UTC FDB022981 Solanesyl pyrophosphate Solanesyl-PP is involved in steroids biosynthesis pathway. It is a product of solanesyl-diphosphate synthase (KEGG). [HMDB] all-trans-Nonaprenyl diate all-trans-Nonaprenyl diphosphate Ditrans,hexacis-nonaprenyl diate Ditrans,hexacis-nonaprenyl diic acid Solanesyl diate Solanesyl diphosphate Solanesyl pyroate Solanesyl pyrophosphate Solanesyl-PP C45H76O7P2 791.0283 790.50662781 ({hydroxy[(3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl)oxy]phosphoryl}oxy)phosphonic acid nonaprenyl diphosphate 146340-00-3 CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(O)(=O)OP(O)(O)=O InChI=1S/C45H76O7P2/c1-37(2)19-11-20-38(3)21-12-22-39(4)23-13-24-40(5)25-14-26-41(6)27-15-28-42(7)29-16-30-43(8)31-17-32-44(9)33-18-34-45(10)35-36-51-54(49,50)52-53(46,47)48/h19,21,23,25,27,29,31,33,35H,11-18,20,22,24,26,28,30,32,34,36H2,1-10H3,(H,49,50)(H2,46,47,48) IVLBHBFTRNVIAP-UHFFFAOYSA-N belongs to the class of organic compounds known as bactoprenol diphosphates. These are polyprenyl compounds consisting of a diphosphate group substituted by a bactoprenyl moiety. Bactoprenol diphosphates Organic compounds Lipids and lipid-like molecules Prenol lipids Polyprenols Aliphatic acyclic compounds Hydrocarbon derivatives Isoprenoid phosphates Monoalkyl phosphates Organic oxides Organic pyrophosphates Organooxygen compounds Polyprenyl diphosphates Polyprenyl monophosphates Polyterpenoids Aliphatic acyclic compound Alkyl phosphate Bactoprenol diphosphate Hydrocarbon derivative Isoprenoid phosphate Monoalkyl phosphate Organic oxide Organic oxygen compound Organic phosphoric acid derivative Organic pyrophosphate Organooxygen compound Phosphoric acid ester Polyprenyl diphosphate Polyprenyl monophosphate Polyterpenoid polyprenol diphosphate Solid logp 8.35 ALOGPS logs -6.39 ALOGPS solubility 3.19e-04 g/l ALOGPS logp 13.58 ChemAxon pka_strongest_acidic 1.77 ChemAxon iupac ({hydroxy[(3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2,6,10,14,18,22,26,30,34-nonaen-1-yl)oxy]phosphoryl}oxy)phosphonic acid ChemAxon average_mass 791.0283 ChemAxon mono_mass 790.50662781 ChemAxon smiles CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(O)(=O)OP(O)(O)=O ChemAxon formula C45H76O7P2 ChemAxon inchi InChI=1S/C45H76O7P2/c1-37(2)19-11-20-38(3)21-12-22-39(4)23-13-24-40(5)25-14-26-41(6)27-15-28-42(7)29-16-30-43(8)31-17-32-44(9)33-18-34-45(10)35-36-51-54(49,50)52-53(46,47)48/h19,21,23,25,27,29,31,33,35H,11-18,20,22,24,26,28,30,32,34,36H2,1-10H3,(H,49,50)(H2,46,47,48) ChemAxon inchikey IVLBHBFTRNVIAP-UHFFFAOYSA-N ChemAxon polar_surface_area 113.29 ChemAxon refractivity 239.55 ChemAxon polarizability 94.52 ChemAxon rotatable_bond_count 29 ChemAxon acceptor_count 5 ChemAxon donor_count 3 ChemAxon physiological_charge -2 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 1085587 Specdb::MsMs 178737 Specdb::MsMs 178738 Specdb::MsMs 178739 Specdb::MsMs 181056 Specdb::MsMs 181057 Specdb::MsMs 181058 Specdb::NmrOneD 276458 Specdb::NmrOneD 276459 Specdb::NmrOneD 276460 Specdb::NmrOneD 276461 Specdb::NmrOneD 276462 Specdb::NmrOneD 276463 Specdb::NmrOneD 276464 Specdb::NmrOneD 276465 Specdb::NmrOneD 276466 Specdb::NmrOneD 276467 Specdb::NmrOneD 276468 Specdb::NmrOneD 276469 Specdb::NmrOneD 276470 Specdb::NmrOneD 276471 Specdb::NmrOneD 276472 Specdb::NmrOneD 276473 Specdb::NmrOneD 276474 Specdb::NmrOneD 276475 Specdb::NmrOneD 276476 Specdb::NmrOneD 276477 HMDB02367 4-hydroxybenzoate polyprenyltransferase, mitochondrial Q96H96 COQ2