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Chemistry, part 2

Content language

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Concept information

organooxygen compound > carbonyl compound > ketone > oxo steroid > atolypene a
... > 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 > ketone > oxo steroid > atolypene a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > ketone > oxo steroid > atolypene a
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > oxo steroid > atolypene a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > atolypene 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 > oxo steroid > atolypene a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > oxo steroid > atolypene a
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > oxo steroid > atolypene a

Preferred term

atolypene a  

Type

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

Broader concept

charge

  • 0

formula

  • C28H45NO3

inchi

  • InChI=1S/C28H45NO3/c1-18(8-7-9-22(29)25(31)32)14-16-27(5)19(2)15-17-28(6)21-11-13-24(30)26(3,4)20(21)10-12-23(27)28/h8,10,19,21-23H,7,9,11-17,29H2,1-6H3,(H,31,32)/b18-8+/t19-,21+,22-,23+,27-,28-/m0/s1

inchikey

  • IQSLRUKIZOBDLU-GVYOKUMQSA-N

mass

  • 443.672

monoisotopicmass

  • 443.33994

smiles

  • O=C1C(C2=CC[C@@H]3[C@]([C@@H](C)CC[C@]3([C@@H]2CC1)C)(CC/C(=C/CC[C@H](N)C(=O)O)/C)C)(C)C

subset

  • 2_STAR

synonym EXACT

  • (E,2S)-8-[(1S,2S,4aR,4bS,10aR)-1,2,4a,8,8-pentamethyl-7-oxo-2,3,4,4b,5,6,10,10a-octahydrophenanthren-1-yl]-2-amino-6-methyloct-5-enoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211982

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