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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

SM(d19:0/PGF1alpha)  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C44H87N2O9P

inchi

  • InChI=1S/C44H87N2O9P/c1-6-8-10-11-12-13-14-15-16-17-18-19-20-25-29-41(48)40(36-55-56(52,53)54-34-33-46(3,4)5)45-44(51)30-26-22-21-24-28-38-39(43(50)35-42(38)49)32-31-37(47)27-23-9-7-2/h31-32,37-43,47-50H,6-30,33-36H2,1-5H3,(H-,45,51,52,53)/b32-31+/t37-,38+,39+,40-,41+,42-,43+/m0/s1

inchikey

  • QWLWDUCIYCOVHP-YQGRSFPWSA-N

mass

  • 819.159

monoisotopicmass

  • 818.61492

smiles

  • P(OC[C@H](NC(=O)CCCCCC[C@@H]1[C@H]([C@H](O)C[C@@H]1O)/C=C/[C@@H](O)CCCCC)[C@H](O)CCCCCCCCCCCCCCCC)(OCC[N+](C)(C)C)([O-])=O

subset

  • 2_STAR

synonym EXACT

  • [(2S,3R)-2-[7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]cyclopentyl]heptanoylamino]-3-hydroxynonadecyl] 2-(trimethylazaniumyl)ethyl phosphate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:231125

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