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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 > lipid > steroid > ergostanoid > gargalol a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > gargalol a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > gargalol a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > ergostanoid > gargalol a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > ergostanoid > gargalol a

Preferred term

gargalol a  

Type

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

Broader concept

charge

  • 0

formula

  • C28H44O3

inchi

  • InChI=1S/C28H44O3/c1-16(2)17(3)7-8-18(4)20-9-10-21-19-15-24(30)28-25(31-28)23(29)12-14-27(28,6)22(19)11-13-26(20,21)5/h7-8,15-18,20-25,29-30H,9-14H2,1-6H3/b8-7+/t17-,18+,20+,21-,22-,23-,24-,25-,26+,27+,28-/m0/s1

inchikey

  • VSKOELNSOFBWQU-VNQQHNGCSA-N

mass

  • 428.657

monoisotopicmass

  • 428.32905

smiles

  • O1[C@@]23[C@@]([C@@H]4C([C@H]5[C@]([C@@H]([C@@H](/C=C/[C@@H](C(C)C)C)C)CC5)(C)CC4)=C[C@@H]2O)(CC[C@@H]([C@H]13)O)C

subset

  • 2_STAR

synonym EXACT

  • (1S,2R,5S,6S,8S,9S,12R,15R,16R)-15-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-2,16-dimethyl-7-oxapentacyclo[9.7.0.02,8.06,8.012,16]octadec-10-ene-5,9-diol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:203493

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