A-25822-L (CHEBI:199534)

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CHEBI:199534 - A-25822-L

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ChEBI ID	CHEBI:199534
ChEBI Name	A-25822-L
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H43NO2
Net Charge	0
Average Mass	425.657
Monoisotopic Mass	425.32938
SMILES	C=C(CC[C@@H](C)C1CC(=O)N=C2C3=C(CC[C@@]21C)[C@@]1(C)CC[C@H](O)C[C@@H]1CC3)C(C)C
InChI	InChI=1S/C28H43NO2/c1-17(2)18(3)7-8-19(4)24-16-25(31)29-26-22-10-9-20-15-21(30)11-13-27(20,5)23(22)12-14-28(24,26)6/h17,19-21,24,30H,3,7-16H2,1-2,4-6H3/t19-,20+,21+,24?,27+,28-/m1/s1
InChIKey	RWTVGINCWISNRO-BYEJKNNRSA-N

Species of Metabolite	Component	Source	Comments
Geotrichum (ncbitaxon:43987)	-	PubMed (4468280)

ChEBI Ontology

Outgoing Relation(s)
	A-25822-L (CHEBI:199534) is a tetrahydropyridine (CHEBI:26921)

IUPAC Name
(6aS,8S,10aS,12aR)-8-hydroxy-10a,12a-dimethyl-1-[(2R)-6-methyl-5-methylideneheptan-2-yl]-2,5,6,6a,7,8,9,10,11,12-decahydro-1H-naphtho[1,2-h]quinolin-3-one

Manual Xrefs	Databases
78439604	ChemSpider