Chem
J-GLOBAL ID：200907059186321728   Nikkaji number：J579.620B

7-Chlorodeoxypodophyllotoxin

7-クロロデオキシポドフィロトキシン
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： C22H21ClO7
Molecular formula furigana： C22-H21-CL-O7
Molecular weight： 432.850
InChI： InChI=1S/C22H21ClO7/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20H,8-9H2,1-3H3/t13-,18+,19-,20+/m0/s1
InChI key： UPDMGTICYKMZRT-LGWHJFRWSA-N
SMILES： COc1cc(cc(OC)c1OC)[C@H]1[C@@H]2[C@H](COC2=O)[C@H](Cl)c2cc3OCOc3cc12
Systematic name  (3)：
  • (5R)-5,5aα,8aβ,9-テトラヒドロ-5β-(3,4,5-トリメトキシフェニル)-9α-クロロフロ[3′,4′:6,7]ナフト[2,3-d]-1,3-ジオキソール-6(8H)-オン
  • (10R,11R,15R,16S)-16-クロロ-10-(3,4,5-トリメトキシフェニル)-4,6,13-トリオキサテトラシクロ[7.7.0.03,7.011,15]ヘキサデカ-1,3(7),8-トリエン-12-オン
  • (10R,11R,15R,16S)-16-chloro-10-(3,4,5-trimethoxyphenyl)-4,6,13-trioxatetracyclo[7.7.0.03,7.011,15]hexadeca-1,3(7),8-trien-12-one
Other name (3)：
  • 7-クロロデオキシポドフィロトキシン
  • 7-Chlorodeoxypodophyllotoxin
  • (5R)-5,5aα,8aβ,9-Tetrahydro-5β-(3,4,5-trimethoxyphenyl)-9α-chlorofuro[3′,4′:6,7]naphtho[2,3-d]-1,3-dioxol-6(8H)-one
Thsaurus map：
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