2-Amino-12-heneicosene-1,3,4-triol; (2ξ,3ξ,4ξ,12E)-form, N-(2ξ-Hydroxydocosanoyl) 

AlkaPlorer ID: AK285536

Synonym: Cameroonemide A, Cameroonamide A

IUPAC Name: 2-hydroxy-N-[(E)-1,3,4-trihydroxyhenicos-12-en-2-yl]docosanamide

Structure

SMILES: CCCCCCCC/C=C/CCCCCCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCCCCCCCC

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InChI: InChI=1S/C43H85NO5/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-37-41(47)43(49)44-39(38-45)42(48)40(46)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h18,22,39-42,45-48H,3-17,19-21,23-38H2,1-2H3,(H,44,49)/b22-18+

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InChIKey: IYVLMQOAMKLJKB-RELWKKBWSA-N

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Reference

PubChem CID: 46854086

CAS: 1256349-73-1

Source

Properties Information

Molecule Weight: 696.1549999999994

TPSA: 110.02

MolLogP: 11.015499999999996

Number of H-Donors: 5

Number of H-Acceptors: 5

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information