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

Preferred term

hericinoid a  

Type

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

Broader concept

charge

  • 0

formula

  • C25H36O7

inchi

  • InChI=1S/C25H36O7/c1-12(2)23-10-8-20(3)7-9-21(4)14(25(20,23)32-23)6-5-13-15-17(21)31-19-24(15,29)18(27)22(28,11-30-19)16(13)26/h5,12,14-19,26-29H,6-11H2,1-4H3/t14-,15+,16+,17-,18-,19-,20-,21+,22-,23+,24+,25+/m0/s1

inchikey

  • RPGNTFOOTHCMMB-PYNPQNLOSA-N

mass

  • 448.556

monoisotopicmass

  • 448.24610

smiles

  • O1[C@H]2O[C@@H]3[C@]4([C@@H]([C@]56O[C@@]5(C(C)C)CC[C@]6(C)CC4)CC=C7[C@H]3[C@@]2(O)[C@@H](O)[C@@](C1)(O)[C@@H]7O)C

subset

  • 2_STAR

synonym EXACT

  • (4S,5R,7R,10S,13R,14S,16S,19S,20S,21R,22R,23R)-10,13-dimethyl-7-propan-2-yl-6,15,17-trioxaheptacyclo[17.3.1.04,13.05,7.05,10.014,22.016,21]tricos-1-ene-19,20,21,23-tetrol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215211

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