CHEBI:205412 - Marasmene B

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 Marasmene B
ChEBI ID CHEBI:205412
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O3
Net Charge 0
Average Mass 250.338
Monoisotopic Mass 250.15689
InChI InChI=1S/C15H22O3/c1-14(2)6-3-7-15-10(14)5-4-9-8-17-12(11(9)15)18-13(15)16/h4,10-13,16H,3,5-8H2,1-2H3/t10-,11+,12+,13-,15+/m0/s1
InChIKey LPSWGKHKBFIVLU-IHWVXMPCSA-N
SMILES O1[C@H](O)[C@@]23[C@H](C(CCC2)(C)C)CC=C4[C@@H]3[C@@H]1OC4
Metabolite of Species Details
Marasmius (NCBI:txid34448) See: PubMed
ChEBI Ontology
Outgoing Marasmene B (CHEBI:205412) is a furofuran (CHEBI:47790)
IUPAC Name
(1R,6S,12R,14S,15S)-5,5-dimethyl-11,13-dioxatetracyclo[7.5.1.01,6.012,15]pentadec-8-en-14-ol
Manual Xref Database
78437281 ChemSpider
View more database links