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(+)-Arteannuin

MNXM30078 is deprecated and here replaced by MNXM1106895
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1106895 Image of MNXM1106895
referencechebi:182769
formulaC15H22O5
global charge0
mol weight282.336
InChIKeyBLUAFEHZUWYNDE-DCJAHCNHSA-N
InChIInChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14?,15-/m1/s1
SMILESC[C@@H]1CC[C@H]2[C@@H](C)C(=O)O[C@@H]3OC4(C)CC[C@@H]1[C@]32OO4
MNX internals
InChI (mnx)InChI=1/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14?,15-/m1/s1 Image of MNXM1106895
SMILES (mnx)[CH3:1][C@@H:8]1[CH2:4][CH2:5][C@H:11]2[C@@H:9]([CH3:2])[C:12](=[O:16])[O:17][C@H:13]3[C@@:15]24[C@H:10]1[CH2:6][CH2:7][C:14]([CH3:3])([O:18]3)[O:19][O:20]4
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:182769
chebi:182769
BLUAFEHZUWYNDE-DCJAHCNHSA-N 		(+)-Arteannuin
(4S,5R,8S,9R,12S,13R)-1,5,9-trimethyl-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one

CHEBI:223316
chebi:223316
BLUAFEHZUWYNDE-DCJAHCNHSA-N 		(+)-artemisinin
(3R,5aS,6R,8aS,9R,12S,12aR)-3,6,9-trimethyloctahydro-3,12-epoxypyrano[4,3-j][1,2]benzodioxepin-10(3H)-one
1,5,9-trimethyl-(1R,4S,5R,9R,12S,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one
Octahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin-10(3H)-one
QHS
Qing Hau Sau
Qinghaosu
Quing Hau Sau
arteannuin
artemisinin
artemisinina
artemisinine
artemisininum
huanghuahaosu

kegg.drug:D02481
keggD:D02481
BLUAFEHZUWYNDE-DCJAHCNHSA-N 		Artemisinin (INN)
Qing Hau Sau

seed.compound:cpd06433
seedM:cpd06433
BLUAFEHZUWYNDE-DCJAHCNHSA-N 		Artemisinin
(+)-Arteannuin
1,5,9-trimethyl-(1R,4S,5R,9R,12S,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one
Arteannuin
Artemisinina
Octahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin-10(3H)-one
Qing Hau Sau
Quing Hau Sau
artemisinin
qinghaosu

lipidmaps:LMPR0103190003
lipidmapsM:LMPR0103190003
BLUAFEHZUWYNDE-NNWCWBAJSA-N 		Artemisinin
Arteannuin
Huanghuahaosu
Octahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin-10(3H)-one

kegg.compound:C09538
keggC:C09538
BLUAFEHZUWYNDE-DCJAHCNHSA-N 		Qing Hau Sau
Artemisinin

metacyc.compound:CPD-7561
metacycM:CPD-7561
BLUAFEHZUWYNDE-DCJAHCNHSA-N 		artemisinin
(+)-arteannuin
1,5,9-trimethyl-(1R,4S,5R,9R,12S,13R)-11,14,15,16-tetraoxatetracyclo[10.3.1.04,13.08,13]hexadecan-10-one
arteannuin
artemisinina
octahydro-3,6,9-trimethyl-3,12-epoxy-12H-pyrano(4,3-j)-1,2-benzodioxepin-10(3H)-one
qinghaosu

chebi:8718
keggC:M_C09538
keggD:M_D02481
seedM:M_cpd06433 		secondary/obsolete/fantasy identifier