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Concept information

Preferred term

conicasterol d  

Type

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

Broader concept

charge

  • 0

formula

  • C29H48O3

inchi

  • InChI=1S/C29H48O3/c1-17(2)18(3)8-9-19(4)23-16-25(31)26-22-11-10-21-20(5)24(30)12-13-28(21,7)29(22,32)15-14-27(23,26)6/h17-19,21,23-25,30-32H,5,8-16H2,1-4,6-7H3/t18-,19-,21+,23-,24+,25-,27-,28+,29-/m1/s1

inchikey

  • CKFFPLRELSUIHH-XAHNCEBCSA-N

mass

  • 444.700

monoisotopicmass

  • 444.36035

smiles

  • O[C@@]12[C@@]3([C@@](CCC1=C4[C@@]([C@](C[C@H]4O)([C@@H](CC[C@H](C(C)C)C)C)[H])(CC2)C)(C([C@@H](O)CC3)=C)[H])C

subset

  • 2_STAR

synonym EXACT

  • (3S,5S,9S,10S,13R,15R,17R)-17-[(2R,5R)-5,6-dimethylheptan-2-yl]-10,13-dimethyl-4-methylidene-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3,9,15-triol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:187921

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