Chem
J-GLOBAL ID:200907038647672202   Nikkaji number:J2.475.501K

(9Z,12R)-12-Hydroxy-9-octadecenoic acid (S)-2-[(benzyloxy)methoxy]-3-hydroxypropyl ester

(9Z,12R)-12-ヒドロキシ-9-オクタデセン酸(S)-2-[(ベンジルオキシ)メトキシ]-3-ヒドロキシプロピル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C29H48O6
Molecular formula furigana: C29-H48-O6
Molecular weight: 492.697
InChI: InChI=1S/C29H48O6/c1-2-3-4-14-19-27(31)20-15-9-7-5-6-8-10-16-21-29(32)34-24-28(22-30)35-25-33-23-26-17-12-11-13-18-26/h9,11-13,15,17-18,27-28,30-31H,2-8,10,14,16,19-25H2,1H3/b15-9-/t27-,28+/m1/s1
InChI key: XGUHOUOTDRDDLV-QKLROUEBSA-N
SMILES: CCCCCC[C@@H](O)C/C=C\CCCCCCCC(=O)OC[C@H](CO)OCOCc1ccccc1
Systematic name  (3):
  • (9Z,12R)-12-ヒドロキシ-9-オクタデセン酸(S)-2-[(ベンジルオキシ)メトキシ]-3-ヒドロキシプロピル
  • (2S)-2-[(ベンジルオキシ)メトキシ]-3-ヒドロキシプロピル (9Z,12R)-12-ヒドロキシオクタデカ-9-エノアート
  • (2S)-2-[(benzyloxy)methoxy]-3-hydroxypropyl (9Z,12R)-12-hydroxyoctadec-9-enoate
Other name (1):
  • (9Z,12R)-12-Hydroxy-9-octadecenoic acid (S)-2-[(benzyloxy)methoxy]-3-hydroxypropyl ester
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