Cladophyllol (CHEBI:213100)

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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	Cladophyllol

ChEBI ID	CHEBI:213100

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C15H24O4

Net Charge

Average Mass

268.353

Monoisotopic Mass

268.16746

InChI

InChI=1S/C15H24O4/c1-7-4-10(16)12-9(6-19-14(12)18)8-5-15(2,3)13(17)11(7)8/h7,10-14,16-18H,4-6H2,1-3H3/t7-,10+,11-,12+,13-,14+/m0/s1

InChIKey

SNMKDJCTWGUKRU-OIMJEQPZSA-N

SMILES

O1[C@@H](O)[C@H]2[C@H](O)C[C@H](C)[C@H]3C(=C2C1)CC(C)(C)[C@H]3O

Metabolite of Species	Details
Marasmius cladophyllus (NCBI:txid224028)	See: PubMed

ChEBI Ontology
Outgoing	Cladophyllol (CHEBI:213100) is a oxolanes (CHEBI:26912)

IUPAC Name

(3R,3aR,4R,6S,6aS,7S)-6,8,8-trimethyl-3,3a,4,5,6,6a,7,9-octahydro-1H-azuleno[4,5-c]uran-3,4,7-triol