Chem
J-GLOBAL ID：200907093753003230   Nikkaji number：J148.865A

Isotalatizidine

イソタラチジジン
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： C23H37NO5
Molecular formula furigana： C23-H37-N-O5
Molecular weight： 407.551
InChI： InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3/t12-,13-,14+,15+,16-,17+,18-,19+,20-,21+,22+,23-/m1/s1
InChI key： RBSZCNOWHDHRFZ-VHNKBEDGSA-N
SMILES： CCN1C[C@]2(COC)CC[C@H](O)[C@@]34[C@@H]5C[C@H]6[C@H](O)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@H](C[C@H]23)[C@@H]14
Systematic name  (4)：
  • 20-エチル-16β-メトキシ-4-(メトキシメチル)アコニタン-1α,8,14α-トリオール
  • 4-(メトキシメチル)-16β-メトキシ-20-エチルアコニタン-1α,8,14α-トリオール
  • (1S,2R,3R,4S,5S,6S,8S,9S,10R,13S,16S,17R)-11-エチル-6-メトキシ-13-(メトキシメチル)-11-アザヘキサシクロ[7.7.2.12,5.01,10.03,8.013,17]ノナデカン-4,8,16-トリオール
  • (1S,2R,3R,4S,5S,6S,8S,9S,10R,13S,16S,17R)-11-ethyl-6-methoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
Other name (16)：
  • iso-タラチジジン
  • イソタラチシジン
  • イソタラチジジン
  • Isotalatisidine
  • iso-Talatizidine
Show all
CAS registry number： 7633-68-3
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