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CHEBI:226545 - Nigrosirpexin C

ChEBI IDCHEBI:226545
ChEBI NameNigrosirpexin C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESC=C1[C@@H](CO)C[C@H](O)[C@H](C)[C@@H]2CC(C)(C)C[C@]12O
InChIInChI=1S/C15H26O3/c1-9-12-6-14(3,4)8-15(12,18)10(2)11(7-16)5-13(9)17/h9,11-13,16-18H,2,5-8H2,1,3-4H3/t9-,11-,12+,13+,15+/m1/s1
InChIKeyOPQZTUAVUGSQFW-PYISLEMLSA-N
Species of MetaboliteComponentSourceComments
Irpex lacteus (ncbitaxon:5319) - PubMed (32401511)
ChEBI Ontology
Outgoing Relation(s)
Nigrosirpexin C (CHEBI:226545) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(3aR,5S,7S,8R,8aS)-5-(hydroxymethyl)-2,2,8-trimethyl-4-methylidene-3,5,6,7,8,8a-hexahydro-1H-azulene-3a,7-diol