CHEBI ONTOLOGY - ANNOTATIONS
The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/ . The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/ ). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term: (+)-(5E,12E,2S,3S,4S,9S,11S,15R)-3-cinnamoyloxylathyra-5,12-dien-15-ol-14-one
Accession: CHEBI:67695
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Definition: A lathyrane diterpenoid isolated from the roots of Euphorbia micractina.
Synonyms: exact_synonym: (1aR,2E,4aR,6S,7S,7aS,8E,11aS)-4a-hydroxy-1,1,3,6,9-pentamethyl-4-oxo-1a,4,4a,5,6,7,7a,10,11,11a-decahydro-1H-cyclopenta[a]cyclopropa[f][11]annulen-7-yl (2E)-3-phenylprop-2-enoate
related_synonym: Formula=C29H36O4; InChI=1S/C29H36O4/c1-18-11-13-22-23(28(22,4)5)16-19(2)27(31)29(32)17-20(3)26(24(29)15-18)33-25(30)14-12-21-9-7-6-8-10-21/h6-10,12,14-16,20,22-24,26,32H,11,13,17H2,1-5H3/b14-12+,18-15+,19-16+/t20-,22-,23-,24-,26-,29+/m0/s1; InChIKey=NQXSTPNIDYJOBI-YUPKHPILSA-N; SMILES=C[C@H]1C[C@@]2(O)[C@@H](\\C=C(C)\\CC[C@H]3[C@@H](\\C=C(C)\\C2=O)C3(C)C)[C@H]1OC(=O)\\C=C\\c1ccccc1
xref: PMID:21534583; Reaxys:26278282
Term paths to the root one shortest all shortest one longest all longest one shortest and longest all
Path 1
CHEBI ontology
19811
chemical entity
19840
molecular entity
19809
polyatomic entity
19767
molecule
19702
cyclic compound
19489
macrocycle
6260
lathyrane diterpenoid
0
(+)-(5E,12E,2S,3S,4S,9S,11S,15R)-3-cinnamoyloxylathyra-5,12-dien-15-ol-14-one
0
Path 2
CHEBI ontology
19811
subatomic particle
19809
composite particle
19809
hadron
19840
baryon
19809
nucleon
19809
atomic nucleus
19809
atom
19809
main group element atom
19759
p-block element atom
19759
carbon group element atom
19708
carbon atom
19734
organic molecular entity
19705
heteroorganic entity
19459
organochalcogen compound
19222
organooxygen compound
19137
carbonyl compound
18858
ketone
17163
oxyketone
8906
alpha-oxyketone
8900
alpha-hydroxy ketone
8900
tertiary alpha-hydroxy ketone
8607
(+)-(5E,12E,2S,3S,4S,9S,11S,15R)-3-cinnamoyloxylathyra-5,12-dien-15-ol-14-one
0