Chem
J-GLOBAL ID：200907018696760949   Nikkaji number：J9.640G

(+)-Vellosimine

(+)-ベロシミン
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： C19H20N2O
Molecular formula furigana： C19-H20-N2-O
Molecular weight： 292.382
InChI： InChI=1S/C19H20N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,10,13,15,17-18,20H,7-9H2,1H3/b11-2-/t13-,15+,17-,18-/m0/s1
InChI key： MHASSCPGKAMILD-VICVVEARSA-N
SMILES： C/C=C\1/CN2[C@H]3Cc4c([nH]c5ccccc45)[C@@H]2C[C@@H]1[C@H]3C=O
Systematic name  (3)：
  • サルパガン-17-アール
  • (1S,12S,13R,14R,15E)-15-エチリデン-3,17-ジアザペンタシクロ[12.3.1.02,10.04,9.012,17]オクタデカ-2(10),4,6,8-テトラエン-13-カルバルデヒド
  • (1S,12S,13R,14R,15E)-15-ethylidene-3,17-diazapentacyclo[12.3.1.02,10.04,9.012,17]octadeca-2(10),4,6,8-tetraene-13-carbaldehyde
Other name (5)：
  • ベロシミン
  • Vellosimine
  • Sarpagan-17-al
  • (+)-ベロシミン
  • (+)-Vellosimine
CAS registry number： 6874-98-2
KEGG COMPOUND： C11634
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