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Concept information

Preferred term

igniaren a  

Type

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

Broader concept

charge

  • 0

formula

  • C30H46O2

inchi

  • InChI=1S/C30H46O2/c1-18(2)19(3)17-27(32)21(5)23-11-15-30(8)25-10-9-22-20(4)26(31)13-14-28(22,6)24(25)12-16-29(23,30)7/h10,12,18,20-23,27,32H,3,9,11,13-17H2,1-2,4-8H3/t20-,21-,22?,23+,27+,28-,29+,30-/m0/s1

inchikey

  • NNWAYAOFBKDQIA-XKLJGBPTSA-N

mass

  • 438.696

monoisotopicmass

  • 438.34978

smiles

  • O=C1[C@H](C2[C@](C=3C([C@]4([C@]([C@@H]([C@@H]([C@H](O)CC(=C)C(C)C)C)CC4)(C)CC3)C)=CC2)(C)CC1)C

subset

  • 2_STAR

synonym EXACT

  • (4S,10S,13R,14R,17R)-17-[(2S,3R)-3-hydroxy-6-methyl-5-methylideneheptan-2-yl]-4,10,13,14-tetramethyl-2,4,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201135

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