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CHEBI:218085 - Nigirpexin E

ChEBI IDCHEBI:218085
ChEBI NameNigirpexin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESC[C@H]1C[C@H](O)[C@H](CO)C(CO)=C2CC(C)(C)C[C@H]21
InChIInChI=1S/C15H26O3/c1-9-4-14(18)13(8-17)12(7-16)11-6-15(2,3)5-10(9)11/h9-10,13-14,16-18H,4-8H2,1-3H3/t9-,10-,13+,14-/m0/s1
InChIKeyPJUHQEIKCZOLQE-ZNIXKSQXSA-N
Species of MetaboliteComponentSourceComments
Irpex lacteus (ncbitaxon:5319)
- PubMed (30076888)
- PubMed (32401511)
ChEBI Ontology
Outgoing Relation(s)
Nigirpexin E (CHEBI:218085) is a secondary alcohol (CHEBI:35681)
IUPAC Names 
(3aS,4S,6S,7S)-7,8-bis(hydroxymethyl)-2,2,4-trimethyl-3,3a,4,5,6,7-hexahydro-1H-azulen-6-ol
(7S,8R,8aR)-7,8-dihydroxy-7-methyl-3-[(1E,3E)-penta-1,3-dienyl]-8,8a-dihydro-1H-isochromen-6-one