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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > alkaloid > indole alkaloid > terpenoid indole alkaloid > hemiterpenoid indole alkaloid > ergot alkaloid > clavicipitic acid > (-)-trans-clavicipitic acid

Preferred term

(-)-trans-clavicipitic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C16H18N2O2

inchi

  • InChI=1S/C16H18N2O2/c1-9(2)6-13-11-4-3-5-12-15(11)10(8-17-12)7-14(18-13)16(19)20/h3-6,8,13-14,17-18H,7H2,1-2H3,(H,19,20)/t13-,14+/m1/s1

inchikey

  • VZMAHZAQMKNJIG-KGLIPLIRSA-N

mass

  • 270.32640

monoisotopicmass

  • 270.13683

smiles

  • CC(C)=C[C@H]1N[C@@H](Cc2c[nH]c3cccc1c23)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • (4S,6R)-6-(2-methylprop-1-en-1-yl)-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxylic acid

synonym RELATED

  • (4S,6R)-clavicipitic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:48270

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