Chem
J-GLOBAL ID：200907073330427512   Nikkaji number：J146.605D

6-Deoxocastasterone

6-デオキソカスタステロン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C28H50O4
Molecular formula furigana： C28-H50-O4
Molecular weight： 450.704
InChI： InChI=1S/C28H50O4/c1-15(2)16(3)25(31)26(32)17(4)20-9-10-21-19-8-7-18-13-23(29)24(30)14-28(18,6)22(19)11-12-27(20,21)5/h15-26,29-32H,7-14H2,1-6H3/t16-,17-,18-,19-,20+,21-,22-,23-,24+,25+,26+,27+,28-/m0/s1
InChI key： VXBLCLVRWCLEOX-BFYSZXNBSA-N
SMILES： CC(C)[C@H](C)[C@@H](O)[C@H](O)[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C
Systematic name  (3)：
  • (22R,23R,24S)-5α-エルゴスタン-2α,3α,22,23-テトラオール
  • (2S,3R,4R,5S)-2-[(1R,3aS,3bR,5aS,7S,8R,9aS,9bS,11aS)-7,8-ジヒドロキシ-9a,11a-ジメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-1-イル]-5,6-ジメチルヘプタン-3,4-ジオール
  • (2S,3R,4R,5S)-2-[(1R,3aS,3bR,5aS,7S,8R,9aS,9bS,11aS)-7,8-dihydroxy-9a,11a-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-1-yl]-5,6-dimethylheptane-3,4-diol
Other name (3)：
  • 6-デオキソカスタステロン
  • 6-Deoxocastasterone
  • (22R,23R,24S)-5α-Ergostane-2α,3α,22,23-tetraol
CAS registry number： 87833-54-3
KEGG COMPOUND： C15802
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM