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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
organooxygen compound > carbonyl compound > carboxylic ester > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > tetracyclic diterpenoid > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > tetracyclic diterpenoid > phorbol ester > 12-deoxyphorbaldehyde-13-hexadecanoate

Preferred term

12-deoxyphorbaldehyde-13-hexadecanoate  

Type

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

Broader concept

charge

  • 0

formula

  • C36H56O6

has_role

inchi

  • InChI=1S/C36H56O6/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(38)42-35-22-26(3)36(41)28(31(35)33(35,4)5)21-27(24-37)23-34(40)29(36)20-25(2)32(34)39/h20-21,24,26,28-29,31,40-41H,6-19,22-23H2,1-5H3/t26-,28+,29-,31-,34-,35+,36-/m1/s1

inchikey

  • NFTGKFBSWRGMSO-IEIRSVMLSA-N

mass

  • 584.82620

monoisotopicmass

  • 584.40769

smiles

  • [H][C@@]12C=C(C[C@]3(O)C(=O)C(C)=C[C@@]3([H])[C@@]1(O)[C@H](C)C[C@]1(OC(=O)CCCCCCCCCCCCCCC)[C@@]2([H])C1(C)C)C=O

subset

  • 2_STAR

synonym RELATED

  • (1aR,1bS,4aR,7aS,7bR,8R,9aS)-3-Formyl-4a,7b-dihydroxy-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl palmitate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:69821

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