CHEBI:200305 - Rhizopogone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Rhizopogone
ChEBI ID CHEBI:200305
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H34O4
Net Charge 0
Average Mass 410.554
Monoisotopic Mass 410.24571
InChI InChI=1S/C26H34O4/c1-16(2)14-20-15-19(5)11-7-9-17(3)8-6-10-18(4)12-13-21-23(27)25(29)22(20)26(30)24(21)28/h8,11-12,14,20,27,30H,6-7,9-10,13,15H2,1-5H3/b17-8-,18-12-,19-11-/t20-/m1/s1
InChIKey KKLNZLFIECUADF-OGLCFNMDSA-N
SMILES O=C1C(O)=C2C(=O)C(=C1[C@H](C=C(C)C)CC(=CCCC(C)=CCCC(=CC2)C)C)O
Metabolite of Species Details
Rhizopogon (NCBI:txid5375) See: PubMed
ChEBI Ontology
Outgoing Rhizopogone (CHEBI:200305) is a diterpenoid (CHEBI:23849)
IUPAC Name
(3Z,7Z,11Z,14S)-17,19-dihydroxy-4,8,12-trimethyl-14-(2-methylprop-1-enyl)bicyclo[13.2.2]nonadeca-1(17),3,7,11,15(19)-pentaene-16,18-dione
Manual Xref Database
78436602 ChemSpider
View more database links