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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 > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > allocyafrin b4
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > allocyafrin b4

Preferred term

allocyafrin b4  

Type

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

Broader concept

charge

  • 0

formula

  • C20H28O4

inchi

  • InChI=1S/C20H28O4/c1-11(2)13-8-17(24)20(4)6-5-19(3)14(18(13)20)9-15(22)12(10-21)7-16(19)23/h7-8,11,14-15,18,21-22H,5-6,9-10H2,1-4H3/t14-,15-,18?,19-,20+/m1/s1

inchikey

  • SRUVAUDOCNEFJS-VLEKXVRISA-N

mass

  • 332.440

monoisotopicmass

  • 332.19876

smiles

  • O=C1C=C([C@H](O)C[C@H]2[C@]1(CC[C@@]3(C2C(=CC3=O)C(C)C)C)C)CO

subset

  • 2_STAR

synonym EXACT

  • (3aR,5aR,9R,10aR)-9-hydroxy-8-(hydroxymethyl)-3a,5a-dimethyl-1-propan-2-yl-4,5,9,10,10a,10b-hexahydrocyclohepta[e]indene-3,6-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200106

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