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

Preferred term

chaetolivacine b  

Type

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

Broader concept

charge

  • 0

formula

  • C30H39NO3

inchi

  • InChI=1S/C30H39NO3/c1-7-20(3)25-21(4)16-29(5)15-19(2)13-14-24(29)26(25)27(32)23-18-30(34-6,31-28(23)33)17-22-11-9-8-10-12-22/h7-12,16,18-19,24-26H,13-15,17H2,1-6H3,(H,31,33)/b20-7+/t19-,24+,25-,26+,29+,30+/m1/s1

inchikey

  • WURUSNYKHDFEDN-JJOBWUIXSA-N

mass

  • 461.646

monoisotopicmass

  • 461.29299

smiles

  • O=C1N[C@](OC)(CC2=CC=CC=C2)C=C1C(=O)[C@@H]3[C@@H](C(=C[C@]4([C@H]3CC[C@H](C4)C)C)C)/C(=C/C)/C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:220657

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