Penicilloitin B (CHEBI:205758)

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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	Penicilloitin B

ChEBI ID	CHEBI:205758

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C20H38O5

Net Charge

Average Mass

358.519

Monoisotopic Mass

358.27192

InChI

InChI=1S/C20H38O5/c1-2-3-13-18(22)14-11-9-7-5-4-6-8-10-12-15-20(24)25-17-19(23)16-21/h9,11,18-19,21-23H,2-8,10,12-17H2,1H3/b11-9+

InChIKey

ZGDOOBRKAZVQOQ-PKNBQFBNSA-N

SMILES

O=C(OCC(O)CO)CCCCCCCC/C=C/CC(O)CCCC

Metabolite of Species	Details
Penicilliumspecies (NCBI:txid5081)	See: PubMed

ChEBI Ontology
Outgoing	Penicilloitin B (CHEBI:205758) is a long-chain fatty alcohol (CHEBI:17135)

IUPAC Name

2,3-dihydroxypropyl (E)-13-hydroxyheptadec-10-enoate