Truncateol P (CHEBI:207986)

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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	Truncateol P

ChEBI ID	CHEBI:207986

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H20O4

Net Charge

Average Mass

276.332

Monoisotopic Mass

276.13616

InChI

InChI=1S/C16H20O4/c1-9(2)5-6-10-7-11-16(14(20-16)13(10)17)8-12(19-11)15(3,4)18/h7,11-14,17-18H,1,8H2,2-4H3/t11-,12+,13-,14+,16-/m0/s1

InChIKey

RYJXVFAYRJLCCJ-QKDZRIPBSA-N

SMILES

O1[C@H]2C=C(C#CC(=C)C)[C@H](O)[C@@H]3[C@]2(O3)C[C@@H]1C(O)(C)C

Metabolite of Species	Details
Truncatella angustata (NCBI:txid152316)	See: PubMed

ChEBI Ontology
Outgoing	Truncateol P (CHEBI:207986) is a oxolanes (CHEBI:26912)

IUPAC Name

(1S,3R,4S,7S,9R)-9-(2-hydroxypropan-2-yl)-5-(3-methylbut-3-en-1-ynyl)-2,8-dioxatricyclo[5.3.0.01,3]dec-5-en-4-ol