2-Amino-9-methyl-4,8-octadecadiene-1,3-diol; (2S,3R,4E,8E)-form, N-(2R-Hydroxyhexadecanoyl) 

AlkaPlorer ID: AK286358

Synonym: None

IUPAC Name: N-[(4E,8E)-1,3-dihydroxy-9-methyloctadeca-4,8-dien-2-yl]-2-hydroxyhexadecanamide

Structure

SMILES: CCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)/C=C/CC/C=C(\C)CCCCCCCCC

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InChI: InChI=1S/C35H67NO4/c1-4-6-8-10-12-13-14-15-16-18-20-24-29-34(39)35(40)36-32(30-37)33(38)28-25-21-23-27-31(3)26-22-19-17-11-9-7-5-2/h25,27-28,32-34,37-39H,4-24,26,29-30H2,1-3H3,(H,36,40)/b28-25+,31-27+

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InChIKey: ZVEQCJWYRWKARO-YUEFSBGFSA-N

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Reference

PubChem CID: 131752781

CAS: 95673-08-8

Properties Information

Molecule Weight: 565.9240000000001

TPSA: 89.79

MolLogP: 8.699900000000008

Number of H-Donors: 4

Number of H-Acceptors: 4

RingCount: 0

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information