cis-(7S,8R)-Epoxy-2-methyleicosane (CHEBI:179413)

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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	cis-(7S,8R)-Epoxy-2-methyleicosane

ChEBI ID	CHEBI:179413

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H42O

Net Charge

Average Mass

310.566

Monoisotopic Mass

310.32357

InChI

InChI=1S/C21H42O/c1-4-5-6-7-8-9-10-11-12-13-17-20-21(22-20)18-15-14-16-19(2)3/h19-21H,4-18H2,1-3H3/t20-,21+/m1/s1

InChIKey

PJHDGXKZPWJTBM-RTWAWAEBSA-N

SMILES

O1[C@@H]([C@@H]1CCCCC(C)C)CCCCCCCCCCCC

ChEBI Ontology
Outgoing	cis-(7S,8R)-Epoxy-2-methyleicosane (CHEBI:179413) is a epoxide (CHEBI:32955)

IUPAC Name

(2R,3S)-2-dodecyl-3-(5-methylhexyl)oxirane