Resolvin D1

Details

• Internal ID: 5257070e-6eba-4490-aaea-1cf980180167
• Taxonomy: Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Very long-chain fatty acids
• IUPAC Name: (4Z,7S,8R,9E,11E,13Z,15E,17S,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid
• InChI: InChI=1S/C22H32O5/c1-2-3-9-14-19(23)15-10-6-4-5-7-11-16-20(24)21(25)17-12-8-13-18-22(26)27/h3-12,15-16,19-21,23-25H,2,13-14,17-18H2,1H3,(H,26,27)/b6-4-,7-5+,9-3-,12-8-,15-10+,16-11+/t19-,20+,21-/m0/s1
• InChI Key: OIWTWACQMDFHJG-CCFUIAGSSA-N
• Popularity: 466 references in papers

Physical and Chemical Properties

• Molecular Formula: C₂₂H₃₂O₅
• Molecular Weight: 376.50 g/mol
• Exact Mass: 376.22497412 g/mol
• Topological Polar Surface Area (TPSA): 98.00 Ų
• XlogP: 3.10

Synonyms

• RvD1
• (4Z,7S,8R,9E,11E,13Z,15E,17S,19Z)-7,8,17-Trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid
• CHEBI:81564
• 7S,8R,17S-Trihydroxydocosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid
• 7S,8,17S-trihydroxy-docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoic acid
• RvD1 fatty acid
• RefChem:178923
• 7,8,17-trihydroxy-4,9,11,13,15,19-docosahexaenoic acid
• 7S,8R,17S-Trihydroxy-DHA
• (4Z,7S,8S,9E,11E,13Z,15E,17S,19Z)-7,8,17-trihydroxydocosa-4,9,11,13,15,19-hexaenoic acid
• 7S,8R,17S-trihydroxy-4Z,9E,11E,13Z,15E,19Z-docosahexaenoic acid
• ResolvinD1
• 7S,8,17S-trihydroxy-docosa-4Z,9E,11E,13Z,15E,19Z-hexaenoate
• CHEMBL482796
• orb1989658
• SCHEMBL3317325
• EX-A12283
• LMFA04030011
• AKOS027321503
• AT38824
• (4Z,7s,8r,9e,11e,13z,15e,17s,19z)-7,8,17-trihydroxy-4,9,11,13,15,19-docosahexaenoic acid
• DB-214925
• HY-125527
• CS-0092119
• RESOLVIN D1 (A SOLUTION IN ETHANOL)
• C18178
• T13864
• Q60998703
• (4Z,7S,8R,9E,11E,13Z,15E,17S,19Z)-7,8,17-Tihydroxy-4,9,11,13,15,19-docosahexaenoic Acid;

2D Structure

ADMET Properties (via admetSAR 2)

Target	Value	Probability (raw)	Probability (%)
No predicted properties yet!

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL2581	P07339	Cathepsin D	94.39%	98.95%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	93.42%	96.09%
CHEMBL3060	Q9Y345	Glycine transporter 2	93.41%	99.17%
CHEMBL221	P23219	Cyclooxygenase-1	86.93%	90.17%
CHEMBL4261	Q16665	Hypoxia-inducible factor 1 alpha	83.00%	85.14%
CHEMBL1907591	P30926	Neuronal acetylcholine receptor; alpha4/beta4	81.56%	100.00%

Plants that contains it

There are no matching plants.

Cross-Links

• PubChem: 44251266
• LOTUS: LTS0133768
• wikiData: Q60998703