Source:http://linkedlifedata.com/resource/chebi/id/CHEBI:5542
| Predicate | Object |
|---|---|
| rdf:type | |
| skos:definition |
"A tetracyclic diterpenoid that is grayanotoxane in which the pro-R hydrogen at position 14 is substituted by an acetoxy group and in which the 3beta-, 5-, 6beta-, 10-, and 16- positions are substituted by hydroxy groups." []
|
| skos:inScheme | |
| skos:prefLabel |
grayanotoxin I
|
| skos:altLabel |
(14R)-3beta,5,6beta,10,16-pentahydroxygrayanotoxan-14-yl acetate,
Grayanotoxin I
|
| skos:notation |
Beilstein:2065643 "Beilstein Registry Number",
ChemIDplus:4720-09-6 "CAS Registry Number",
CiteXplore:4293525 "PubMed citation",
CiteXplore:8481104 "PubMed citation",
KEGG COMPOUND:4720-09-6 "CAS Registry Number",
KEGG COMPOUND:C09103 "KEGG COMPOUND",
Reaxys:2065643 "Reaxys Registry Number"
|
| skos:broader | |
| skos:relatedSynonym |
(3beta,6beta,14R)-Grayanotoxane-3,5,6,10,14,16-hexol, 14-acetate,
Perhydro-2beta,4alpha,8alpha,11beta,11abeta-pentahydroxy-1,1,4,8-tetramethyl-7,9a-methano-9aalphaH-cyclopenta(b)heptalen-12beta-yl acetate,
acetylandromedol,
rhodotoxin,
grayanotoxane-3,5,6,10,14,16-hexol 14-acetate,
andromedotoxin,
asebotoxin,
C22H36O7,
[H][C@]12CC[C@H]3[C@@](C)(O)[C@]4([H])C[C@H](O)C(C)(C)[C@@]4(O)[C@H](O)C[C@@]3(C[C@@]1(C)O)[C@@H]2OC(C)=O,
InChI=1S/C22H36O7/c1-11(23)29-17-12-6-7-13-20(5,27)14-8-15(24)18(2,3)22(14,28)16(25)9-21(13,17)10-19(12,4)26/h12-17,24-28H,6-10H2,1-5H3/t12-,13+,14+,15+,16-,17-,19-,20-,21+,22+/m1/s1,
InChIKey=NXCYBYJXCJWMRY-VGBBEZPXSA-N
|