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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 > kaurane diterpenoid > phlebiakauranol aldehyde
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > kaurane diterpenoid > phlebiakauranol aldehyde

Preferred term

phlebiakauranol aldehyde  

Type

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

Broader concept

charge

  • 0

formula

  • C20H30O6

inchi

  • InChI=1S/C20H30O6/c1-15(2)6-4-7-16(3)12(15)5-8-17-9-18(24,11-21)19(25,10-17)13(22)14(23)20(16,17)26/h11-13,22,24-26H,4-10H2,1-3H3/t12-,13+,16-,17-,18+,19-,20+/m1/s1

inchikey

  • YRNWJHCNUMMHJM-MSSXRYPISA-N

mass

  • 366.454

monoisotopicmass

  • 366.20424

smiles

  • O=C1[C@]2(O)[C@]3([C@@H](C(CCC3)(C)C)CC[C@]24C[C@]([C@@]([C@H]1O)(O)C4)(O)C=O)C

subset

  • 2_STAR

synonym EXACT

  • (1S,4R,9R,10R,12R,13R,14R)-10,12,13,14-tetrahydroxy-5,5,9-trimethyl-11-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-14-carbaldehyde

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:224862

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