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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 > esulatin m, (rel)-
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > esulatin m, (rel)-

Preferred term

esulatin m, (rel)-  

Type

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

Broader concept

charge

  • 0

formula

  • C36H47NO11

has_role

inchi

  • InChI=1S/C36H47NO11/c1-19(2)33(42)46-27-16-28(47-34(43)26-12-11-15-37-18-26)35(9,10)14-13-20(3)32(41)36(48-25(8)40)17-21(4)30(44-23(6)38)29(36)31(22(27)5)45-24(7)39/h11-15,18-21,27-31H,5,16-17H2,1-4,6-10H3/b14-13+/t20-,21+,27-,28-,29-,30+,31+,36-/m1/s1

inchikey

  • XYOKQSPGNNDHGL-SDIFRHJLSA-N

mass

  • 669.75850

monoisotopicmass

  • 669.31491

smiles

  • [H][C@]12[C@@H](OC(C)=O)[C@@H](C)C[C@]1(OC(C)=O)C(=O)[C@H](C)/C=C/C(C)(C)[C@@H](C[C@@H](OC(=O)C(C)C)C(=C)[C@@H]2OC(C)=O)OC(=O)c1cccnc1

subset

  • 2_STAR

synonym RELATED

  • rel-3beta,5alpha,15beta-triacetoxy-7beta-isobutanoyloxy-9alpha-nicotinoyloxyjatropha-6(17),11-dien-14-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68182

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