CHEBI:199341 - Hamigeran H

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 Hamigeran H
ChEBI ID CHEBI:199341
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H30O5
Net Charge 0
Average Mass 374.477
Monoisotopic Mass 374.20932
InChI InChI=1S/C22H30O5/c1-11(2)14-7-8-21(5)17(14)15-9-12(3)10-16(24)18(15)22(6,26)19(25)20(21)27-13(4)23/h9-11,14,17,20,24,26H,7-8H2,1-6H3/t14-,17-,20+,21-,22-/m1/s1
InChIKey KGGPBWHTMLVPDY-FKMWYYCZSA-N
SMILES O=C1[C@](O)(C2=C(O)C=C(C)C=C2[C@@H]3[C@]([C@H]1OC(=O)C)(CC[C@@H]3C(C)C)C)C
Metabolite of Species Details
Hamigera (NCBI:txid39196) See: PubMed
ChEBI Ontology
Outgoing Hamigeran H (CHEBI:199341) is a phenols (CHEBI:33853)
IUPAC Name
[(1R,3aR,4R,6R,10bR)-6,7-dihydroxy-3a,6,9-trimethyl-5-oxo-1-propan-2-yl-2,3,4,10b-tetrahydro-1H-benzo[e]azulen-4-yl] acetate
Manual Xref Database
30771405 ChemSpider
View more database links