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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 > isoprenoid > terpenoid > sesquiterpenoid > chloriolin c
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > chloriolin c

Preferred term

chloriolin c  

Type

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

Broader concept

charge

  • 0

formula

  • C23H35ClO6

inchi

  • InChI=1S/C23H35ClO6/c1-5-6-7-8-9-10-14(26)30-20-15-13(11-21(20,2)3)18(27)16-17(24)19(28)23(29,12-25)22(15,16)4/h13,15,18,20,25,27,29H,5-12H2,1-4H3/t13-,15-,18-,20+,22-,23-/m0/s1

inchikey

  • YDXXLMJEKBHUEM-OXYHHQORSA-N

mass

  • 442.980

monoisotopicmass

  • 442.21222

smiles

  • ClC=1C(=O)[C@@](O)(CO)[C@@]2(C1[C@@H](O)[C@H]3CC([C@@H]([C@@H]23)OC(=O)CCCCCCC)(C)C)C

subset

  • 2_STAR

synonym EXACT

  • [(3S,3aS,3bR,4R,6aS,7S)-1-chloro-3,7-dihydroxy-3-(hydroxymethyl)-3a,5,5-trimethyl-2-oxo-4,6,6a,7-tetrahydro-3bH-cyclopenta[a]pentalen-4-yl] octanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197625

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