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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid derivative > icosanoid > prostanoid > clavulone > punaglandin 1

Preferred term

punaglandin 1  

Type

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

Broader concept

charge

  • 0

formula

  • C27H37ClO10

inchi

  • InChI=1S/C27H37ClO10/c1-6-7-8-9-10-11-15-27(34)16-20(28)24(33)23(27)26(38-19(4)31)25(37-18(3)30)21(36-17(2)29)13-12-14-22(32)35-5/h7-8,10-11,16,21,23,25-26,34H,6,9,12-15H2,1-5H3/b8-7-,11-10-/t21-,23+,25+,26+,27+/m0/s1

inchikey

  • BSCHSQOJMPJDPL-KYWLMOCBSA-N

mass

  • 557.030

monoisotopicmass

  • 556.20753

smiles

  • ClC=1C(=O)[C@@]([C@@](O)(C/C=C/C/C=C/CC)C1)([C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)CCCC(OC)=O)[H]

subset

  • 2_STAR

synonym EXACT

  • methyl (5S,6R,7R)-5,6,7-triacetyloxy-7-[(1R,2S)-4-chloro-2-hydroxy-2-[(2Z,5Z)-octa-2,5-dienyl]-5-oxocyclopent-3-en-1-yl]heptanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:185892

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