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archaetidylserine

PropertiesImage
MNX_IDMNXM5625 Image of MNXM5625
referencechebi:71517
formulaC46H77NO8P
global charge-1
mol weight803.095
InChIKeyUPNGZNGTSDAVMT-JAQDALRISA-M
InChIInChI=1S/C46H78NO8P/c1-36(2)17-11-19-38(5)21-13-23-40(7)25-15-27-42(9)29-31-52-33-44(34-54-56(50,51)55-35-45(47)46(48)49)53-32-30-43(10)28-16-26-41(8)24-14-22-39(6)20-12-18-37(3)4/h17-18,21-22,25-26,29-30,44-45H,11-16,19-20,23-24,27-28,31-35,47H2,1-10H3,(H,48,49)(H,50,51)/p-1/b38-21+,39-22+,40-25+,41-26+,42-29+,43-30+/t44-,45-/m0/s1
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COC[C@@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
MNX internals
InChI (mnx)InChI=1/C46H78NO8P/c1-36(2)17-11-19-38(5)21-13-23-40(7)25-15-27-42(9)29-31-52-33-44(34-54-56(50,51)55-35-45(47)46(48)49)53-32-30-43(10)28-16-26-41(8)24-14-22-39(6)20-12-18-37(3)4/h17-18,21-22,25-26,29-30,44-45H,11-16,19-20,23-24,27-28,31-35,47H2,1-10H3,(H,48,49)(H,50,51)/b38-21+,39-22+,40-25+,41-26+,42-29+,43-30+/t44-,45-/m0/s1 Image of MNXM5625
SMILES (mnx)[CH3:1][C:36]([CH3:2])=[CH:17][CH2:11][CH2:19]/[C:38]([CH3:5])=[CH:21]/[CH2:13][CH2:23]/[C:40]([CH3:7])=[CH:25]/[CH2:15][CH2:27]/[C:42]([CH3:9])=[CH:29]/[CH2:31][O:52][CH2:33][C@@H:44]([CH2:34][O:54][P:56]([OH:50])(=[O:51])[O:55][CH2:35][C@@H:45]([C:46](=[O:48])[OH:49])[NH2:47])[O:53][CH2:32]/[CH:30]=[C:43](\[CH3:10])[CH2:28][CH2:16]/[CH:26]=[C:41](\[CH3:8])[CH2:24][CH2:14]/[CH:22]=[C:39](\[CH3:6])[CH2:20][CH2:12][CH:18]=[C:37]([CH3:3])[CH3:4]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:71517
chebi:71517
UPNGZNGTSDAVMT-JAQDALRISA-M 		archaetidylserine
(2S,8S,12E,16E,20E)-2-azaniumyl-13,17,21,25-tetramethyl-5-oxido-8-{[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]oxy}-4,6,10-trioxa-5-phosphahexacosa-12,16,20,24-tetraen-1-oate 5-oxide
2,3-bis-O-(geranylgeranyl)-sn-glycero-3-phospho-L-serine(1-)

kegg.compound:C20466
keggC:C20466
UPNGZNGTSDAVMT-JAQDALRISA-N 		2,3-Bis-(O-geranylgeranyl)-sn-glycero-1-phospho-L-serine

CHEBI:71591
chebi:71591
UPNGZNGTSDAVMT-JAQDALRISA-N 		2,3-bis-O-(geranylgeranyl)-sn-glycero-3-phospho-L-serine
2,3-Bis-O-(geranylgeranyl)-sn-glycero-1-phospho-L-serine
O-{[(2S)-2,3-bis{[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]oxy}propoxy](hydroxy)phosphoryl}-L-serine
archaetidylserine

metacyc.compound:CPD-10741
metacycM:CPD-10741
UPNGZNGTSDAVMT-JAQDALRISA-M 		2,3-bis-O-geranylgeranyl-sn-glycero-1-phosphoserine
2,3-bis-O-(geranylgeranyl)-sn-glycero-1-phospho-L-serine
unsaturated archaetidylserine

lipidmaps:LMGP03040002
lipidmapsM:LMGP03040002
UPNGZNGTSDAVMT-JAQDALRISA-N 		PS dO-16:4(3E,6E,10E,14E)(3Me,7Me,11Me,15Me)/16:4(3E,6E,10E,14E)(3Me,7Me,11Me,15Me)
2,3-bis-O-(geranylgeranyl)-sn-glycero-1-phospho-L-serine
PS dO-40:8
archaetidylserine

seed.compound:cpd22795
seedM:cpd22795
UPNGZNGTSDAVMT-JAQDALRISA-M 		archaetidylserine
2,3-Bis-O-(geranylgeranyl)-sn-glycero-1-phospho-L-serine
2,3-bis-O-(geranylgeranyl)-sn-glycero-1-phospho-L-serine
unsaturated archaetidylserine

keggC:M_C20466
seedM:M_cpd22795 		secondary/obsolete/fantasy identifier