7-[3-(Undeca-2,5-dien-1-yl)oxiran-2-yl]hept-5-enoic acid

HCID 1901CAS 81246-85-7
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Basic information

Standard SMILES
CCCCCC=CCC=CCC1OC1CC=CCCCC(=O)O
InChIKey
DBWQSCSXHFNTMO-UHFFFAOYSA-N
Molecular formula
C20H32O3
Average molar mass
320.5 g/mol
Monoisotopic mass
320.23514488

Names & identifiers

Preferred name
7-[3-(Undeca-2,5-dien-1-yl)oxiran-2-yl]hept-5-enoic acid
IUPAC
7-(3-undeca-2,5-dienyloxiran-2-yl)hept-5-enoic acid

Names & synonyms

7-(3-undeca-2,5-dienyloxiran-2-yl)hept-5-enoic acid7-[3-(undeca-2,5-dien-1-yl)oxiran-2-yl]hept-5-enoic acid8(9)-EpETrE(?)8(9)-EET(+/-)8,9-EET(+/-)8,9-EPOXYEICOSA-5Z,11Z,14Z-TRIENOIC ACIDCBiol_001857KBioGR_000201KBioSS_000201orb2802229SCHEMBL2508715KBio2_000201
Show more names
KBio2_002769KBio2_005337KBio3_000401KBio3_000402DTXSID80868605Bio1_000143Bio1_000632Bio1_001121

Database identifiers

CAS
81246-85-7
PubChem CID
1901
DTXSID
DTXSID80868605

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
49.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
14
Heavy atoms
23

Related reactions

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Linked notes

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