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Chemistry, part 2

Content language

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

Concept information

... > organooxygen compound > carbonyl compound > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > janthinopolyenemycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > janthinopolyenemycin a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > janthinopolyenemycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic acid > carboxylic acid > monocarboxylic acid > fatty acid > medium-chain fatty acid > janthinopolyenemycin a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > fatty acid > medium-chain fatty acid > janthinopolyenemycin a

Preferred term

janthinopolyenemycin a  

Type

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

Broader concept

charge

  • 0

formula

  • C26H36O3

inchi

  • InChI=1S/C26H36O3/c1-6-18(2)24-20(4)17-21-22(15-14-19(3)25(21)29)26(24,5)16-12-10-8-7-9-11-13-23(27)28/h6-13,16-17,19,21-22,24-25,29H,14-15H2,1-5H3,(H,27,28)/b9-7+,10-8+,13-11+,16-12+,18-6+/t19-,21-,22+,24+,25-,26-/m0/s1

inchikey

  • NRPCUDXRWZSLDT-CBKDNREWSA-N

mass

  • 396.571

monoisotopicmass

  • 396.26645

smiles

  • O=C(O)/C=C/C=C/C=C/C=C/[C@@]1([C@@H](C(=C[C@H]2[C@H]1CC[C@@H]([C@@H]2O)C)C)/C(=C/C)/C)C

subset

  • 2_STAR

synonym EXACT

  • (2E,4E,6E,8E)-9-[(1S,2R,4aS,5S,6S,8aR)-2-[(E)-but-2-en-2-yl]-5-hydroxy-1,3,6-trimethyl-4a,5,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]nona-2,4,6,8-tetraenoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218052

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