Chem
J-GLOBAL ID：200907076272595344   Nikkaji number：J1.708.622G

14,15-PECPC

1-パルミトイル-2-(14,15-エポキシシクロペンテノン)-sn-グリセロ-3-ホスホリルコリン
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： C44H76[N+]O9[O-]P
Molecular formula furigana： C44-H76-N-O10-P
Molecular weight： 810.063
InChI： InChI=1S/C44H76NO10P/c1-6-8-10-11-12-13-14-15-16-17-18-19-24-28-43(47)51-35-38(36-53-56(49,50)52-33-32-45(3,4)5)54-44(48)29-25-21-20-23-26-37-30-31-40(46)39(37)34-42-41(55-42)27-22-9-7-2/h20,23,30-31,34,37-38,41-42H,6-19,21-22,24-29,32-33,35-36H2,1-5H3/b23-20-,39-34?/t37?,38-,41?,42?/m1/s1
InChI key： GAJVDNFFXQLHPV-DZMHLUEISA-N
SMILES： CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCC/C=C\CC1C=CC(=O)C1=CC1OC1CCCCC
Systematic name  (3)：
  • [O-[1-O-パルミトイル-2-O-[(5Z)-1-オキソ-7-[2-[2,3-エポキシオクタン-1-イリデン]-3-オキソ-4-シクロペンテニル]-5-ヘプテン-1-イル]-L-グリセロ-3-ホスホ]コリン]アニオン
  • (2-{[(2R)-3-(ヘキサデカノイルオキシ)-2-{[(5Z)-7-{4-オキソ-5-[(3-ペンチルオキシラン-2-イル)メチリデン]シクロペンタ-2-エン-1-イル}ヘプタ-5-エノイル]オキシ}プロピル ホスホナト]オキシ}エチル)トリメチルアザニウム
  • (2-{[(2R)-3-(hexadecanoyloxy)-2-{[(5Z)-7-{4-oxo-5-[(3-pentyloxiran-2-yl)methylidene]cyclopent-2-en-1-yl}hept-5-enoyl]oxy}propyl phosphonato]oxy}ethyl)trimethylazanium
Other name (4)：
  • [O-[1-O-Palmitoyl-2-O-[(5Z)-1-oxo-7-[2-[2,3-epoxyoctane-1-ylidene]-3-oxo-4-cyclopentenyl]-5-heptene-1-yl]-L-glycero-3-phospho]choline]anion
  • 14,15-PECPC
  • 1-パルミトイル-2-(14,15-エポキシシクロペンテノン)-sn-グリセロ-3-ホスホリルコリン
  • 1-Palmitoyl-2-(14,15-epoxycyclopentenone)-sn-glycero-3-phosphorylcholine
Thsaurus map：
Thesaurus Map

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