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Concept information

... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 7-oxo steroid > zhankuic acid a methyl ester
organooxygen compound > ester > steroid ester > zhankuic acid a methyl ester
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 3-oxo steroid > zhankuic acid a methyl ester
... > organooxygen compound > carbonyl compound > ketone > oxo steroid > 11-oxo steroid > zhankuic acid a methyl ester

Preferred term

zhankuic acid a methyl ester  

Type

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

charge

  • 0

formula

  • C30H42O5

has_functional_parent

inchi

  • InChI=1S/C30H42O5/c1-16(18(3)28(34)35-7)8-9-17(2)20-10-11-21-26-24(32)14-22-19(4)23(31)12-13-29(22,5)27(26)25(33)15-30(20,21)6/h17-22H,1,8-15H2,2-7H3/t17-,18?,19+,20-,21+,22+,29+,30-/m1/s1

inchikey

  • NZJIIJSJLBIJDO-RTMVVRFTSA-N

mass

  • 482.65150

monoisotopicmass

  • 482.30322

smiles

  • COC(=O)C(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)[C@@H](C)[C@@H]1CC3=O

subset

  • 3_STAR

synonym EXACT

  • methyl (4alpha,5alpha)-4-methyl-3,7,11-trioxoergosta-8,24(28)-dien-26-oate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:70310

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