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Chemistry, part 2

Content language

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

Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > phenols > vancouverone b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > phenols > vancouverone b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > phenols > vancouverone b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic aromatic compound > phenols > vancouverone b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > phenols > vancouverone b

Preferred term

vancouverone b  

Type

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

Broader concept

charge

  • 0

formula

  • C22H29NO5

inchi

  • InChI=1S/C22H29NO5/c1-5-12(2)10-13(3)11-14(4)19(25)17-21(27)18(23-22(17)28)20(26)15-6-8-16(24)9-7-15/h5-9,13-14,18,20,24-26H,10-11H2,1-4H3,(H,23,28)/t13-,14-,18-,20-/m0/s1

inchikey

  • XMKADGQOSSRGKD-OACKDKIBSA-N

mass

  • 387.476

monoisotopicmass

  • 387.20457

smiles

  • O=C1N[C@@H]([C@@H](O)C2=CC=C(O)C=C2)C(C1=C(O)[C@H](C[C@H](CC(=CC)C)C)C)=O

subset

  • 2_STAR

synonym EXACT

  • (5S)-5-[(S)-hydroxy-(4-hydroxyphenyl)methyl]-3-[(2S,4R)-1-hydroxy-2,4,6-trimethyloct-6-enylidene]pyrrolidine-2,4-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214945

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