Chem
J-GLOBAL ID:200907055748176763
Nikkaji number:J5.975G
Homochelidonine
ホモケリドニン
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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:
C21 H23 NO5
Molecular formula furigana:
C21-H23-N-O5
Molecular weight:
369.417
InChI:
InChI=1S/C21H23NO5/c1-22-9-14-12(4-5-16(24-2)21(14)25-3)19-15(23)6-11-7-17-18(27-10-26-17)8-13(11)20(19)22/h4-5,7-8,15,19-20,23H,6,9-10H2,1-3H3/t15-,19-,20+/m0/s1
InChI key:
MADYLZJCRKUBIK-RYGJVYDSSA-N
SMILES:
COc1ccc2[C@H]3[C@@H](O)Cc4cc5OCOc5cc4[C@H]3N(C)Cc2c1OC
Systematic name (3):
(4bR)-4b,5,6,11bα,12,13-ヘキサヒドロ-1,2-ジメトキシ-12-メチル[1,3]ベンゾジオキソロ[5,6-c]フェナントリジン-5β-オール
(1S,12S,13R)-17,18-ジメトキシ-21-メチル-5,7-ジオキサ-21-アザペンタシクロ[11.8.0.02,10 .04,8 .014,19 ]ヘンイコサ-2,4(8),9,14,16,18-ヘキサエン-12-オール
(1S,12S,13R)-17,18-dimethoxy-21-methyl-5,7-dioxa-21-azapentacyclo[11.8.0.02,10 .04,8 .014,19 ]henicosa-2,4(8),9,14,16,18-hexaen-12-ol
Other name (3):
ホモケリドニン
Homochelidonine
(4bR)-4b,5,6,11bα,12,13-Hexahydro-1,2-dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-5β-ol
CAS registry number:
476-33-5
Regulation number (1):
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