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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 > isoprenoid > terpenoid > triterpenoid > butyl lucidenate q
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > triterpenoid > butyl lucidenate q

Preferred term

butyl lucidenate q  

Type

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

Broader concept

charge

  • 0

formula

  • C31H48O6

inchi

  • InChI=1S/C31H48O6/c1-8-9-14-37-25(36)11-10-18(2)19-15-24(35)31(7)27-20(32)16-22-28(3,4)23(34)12-13-29(22,5)26(27)21(33)17-30(19,31)6/h18-20,22,24,32,35H,8-17H2,1-7H3/t18-,19-,20+,22?,24+,29+,30-,31+/m1/s1

inchikey

  • BNIRNFGPJVLFAH-IRSMUZKKSA-N

mass

  • 516.719

monoisotopicmass

  • 516.34509

smiles

  • O=C1C2=C([C@@]3([C@@H](O)C[C@@H]([C@]3(C1)C)[C@@H](CCC(=O)OCCCC)C)C)[C@@H](O)CC4[C@@]2(CCC(C4(C)C)=O)C

subset

  • 2_STAR

synonym EXACT

  • butyl (4R)-4-[(7S,10S,13R,14R,15S,17R)-7,15-dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,5,6,7,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225543

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