Sestermobaraene A (CHEBI:211612)

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CHEBI:211612 - Sestermobaraene A

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ChEBI ID	CHEBI:211612
ChEBI Name	Sestermobaraene A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C25H40
Net Charge	0
Average Mass	340.595
Monoisotopic Mass	340.31300
SMILES	CC(C)[C@@H]1CC[C@]2(C)CCC3(C)CC[C@@H]4[C@H]5CC[C@]4(C)C(=C[C@@H]12)[C@]53C
InChI	InChI=1S/C25H40/c1-16(2)17-7-10-22(3)13-14-23(4)11-8-18-19-9-12-24(18,5)21(15-20(17)22)25(19,23)6/h15-20H,7-14H2,1-6H3/t17-,18+,19+,20-,22+,23?,24-,25-/m0/s1
InChIKey	JLUYQELLOPAXIJ-KPGSVVGFSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces mobaraensis NBRC 13819 = DSM 40847 (ncbitaxon:1223523)	-	PubMed (32749032)

ChEBI Ontology

Outgoing Relation(s)
	Sestermobaraene A (CHEBI:211612) is a sesquiterpenoid (CHEBI:26658)

IUPAC Name
(1R,4R,5S,8R,14R,15S,18R)-1,8,11,15-tetramethyl-5-propan-2-ylpentacyclo[9.7.0.02,15.04,8.014,18]octadec-2-ene