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ent-copalyl diphosphate

PropertiesImage
MNX_IDMNXM720 Image of MNXM720
referencechebi:58553
formulaC20H33O7P2
global charge-3
mol weight447.425
InChIKeyJCAIWDXKLCEQEO-PGHZQYBFSA-K
InChIInChI=1S/C20H36O7P2/c1-15(11-14-26-29(24,25)27-28(21,22)23)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,17-18H,2,6-10,12-14H2,1,3-5H3,(H,24,25)(H2,21,22,23)/p-3/b15-11+/t17-,18-,20+/m1/s1
SMILESC=C1CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1CC/C(C)=C/COP(=O)([O-])OP(=O)([O-])[O-]
MNX internals
InChI (mnx)InChI=1/C20H36O7P2/c1-15(11-14-26-29(24,25)27-28(21,22)23)7-9-17-16(2)8-10-18-19(3,4)12-6-13-20(17,18)5/h11,17-18H,2,6-10,12-14H2,1,3-5H3,(H,24,25)(H2,21,22,23)/b15-11+/t17-,18-,20+/m1/s1 Image of MNXM720
SMILES (mnx)[CH3:1]/[C:15]([CH2:7][CH2:9][C@@H:17]1[C:16](=[CH2:2])[CH2:8][CH2:10][C@@H:18]2[C:19]([CH3:3])([CH3:4])[CH2:12][CH2:6][CH2:13][C@@:20]12[CH3:5])=[CH:11]\[CH2:14][O:26][P:29]([OH:24])(=[O:25])[O:27][P:28]([OH:21])([OH:22])=[O:23]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)26
in models (compartimentalized) 12
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58553
chebi:58553
JCAIWDXKLCEQEO-PGHZQYBFSA-K 		ent-copalyl diphosphate
3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-2-en-1-yl diphosphate
5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate
5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate(3-)

metacyc.compound:ENT-COPALYL-DIPHOSPHATE
metacycM:ENT-COPALYL-DIPHOSPHATE
JCAIWDXKLCEQEO-PGHZQYBFSA-K 		(-)-ent-copalyl diphosphate
(-)-copalyl diphosphate
ent-copalyl diphosphate

CHEBI:28151
chebi:28151
JCAIWDXKLCEQEO-PGHZQYBFSA-N 		5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate
(-)-Copalyl diphosphate
3-methyl-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidenedecahydronaphthalen-1-yl]pent-2-en-1-yl trihydrogen diphosphate
5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphate
5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl trihydrogen diphosphate
ent-Copalyl diphosphate

seed.compound:cpd03629
seedM:cpd03629
JCAIWDXKLCEQEO-PGHZQYBFSA-L 		Copalyl diphosphate
(-)-CDP
(-)-CPP
(-)-Copalyl diphosphate
(-)-copalyl diphosphate
(-)-ent-copalyl diphosphate
ent-CDP
ent-CPP
ent-Copalyl diphosphate
ent-copalyl diphosphate

lipidmaps:LMPR0104030001
lipidmapsM:LMPR0104030001
JCAIWDXKLCEQEO-PGHZQYBFSA-N 		ent-Copalyl diphosphate

kegg.compound:C06089
keggC:C06089
JCAIWDXKLCEQEO-PGHZQYBFSA-N 		ent-Copalyl diphosphate
(-)-Copalyl diphosphate
hmdb:HMDB0301826
JCAIWDXKLCEQEO-PGHZQYBFSA-N 		ent-Copalyl diphosphate
(-)-Copalyl diphosphate
(-)-Copalyl diphosphoric acid
(-)-copalyl diphosphate
5a,9a,10b-Labda-8(20),13-dien-15-yl diphosphate
5a,9a,10b-Labda-8(20),13-dien-15-yl diphosphoric acid
5alpha,9alpha,10beta-Labda-8(20),13-dien-15-yl diphosphate
5alpha,9alpha,10beta-Labda-8(20),13-dien-15-yl diphosphoric acid
5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphate
5alpha,9alpha,10beta-labda-8(20),13-dien-15-yl diphosphoric acid
5b,9a,10a-Labda-8(20),13-dien-15-yl diphosphate
5b,9a,10a-Labda-8(20),13-dien-15-yl diphosphoric acid
5beta,9alpha,10alpha-Labda-8(20),13-dien-15-yl diphosphoric acid
5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphate
5beta,9alpha,10alpha-labda-8(20),13-dien-15-yl diphosphoric acid
[({[(2E)-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidene-decahydronaphthalen-1-yl]-3-methylpent-2-en-1-yl]oxy}(hydroxy)phosphoryl)oxy]phosphonic acid
ent-Copalyl diphosphoric acid

chebi:12813
chebi:3873
keggC:M_C06089
seedM:M_cpd03629 		secondary/obsolete/fantasy identifier