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Substance Name: Lophirachalcone
RN: 122585-40-4
InChIKey: HUSLZNYNWSUNJK-GEIIHYOISA-N

Note

  • An anti-tumor promoter isolated from Lophira alata; a chalcone tetramer.

Molecular Weight

  • 1009.02
 
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Names and Synonyms

Name of Substance

  • Lophirachalcone

Systematic Name

  • 2-Propen-1-one, 3-(3-((5-(4-(2,4-dihydroxybenzoyl)tetrahydro-5-(4-hydroxyphenyl)-3-((4-hydroxyphenyl)methyl)-2-furanyl)-2,4-dihydroxyphenyl)(2,4-dihydroxyphenyl)methyl)-2-(4-hydroxyphenyl)-5-benzofuranyl)-1-(2,4-dihydroxyphenyl)-, (2alpha(R*(2R*,3R*,5(E))),3alpha,4beta,5alpha)-(+)-

Registry Numbers

CAS Registry Number

  • 122585-40-4

System Generated Number

  • 0122585404

Structure Descriptors

InChI

1S/C60H48O15/c61-34-9-1-30(2-10-34)24-46-56(57(73)42-20-17-39(66)27-50(42)70)59(33-7-13-36(63)14-8-33)75-60(46)44-28-43(51(71)29-52(44)72)54(41-19-16-38(65)26-49(41)69)55-45-23-31(3-21-47(67)40-18-15-37(64)25-48(40)68)4-22-53(45)74-58(55)32-5-11-35(62)12-6-32/h1-23,25-29,46,54-56,58-66,68-72H,24H2/b21-3+/t46-,54+,55?,56+,58-,59+,60-/m0/s1

InChIKey

HUSLZNYNWSUNJK-GEIIHYOISA-N

Smiles

C(\C=C\c1cc2[C@@H]([C@@H](Oc2cc1)c1ccc(cc1)O)[C@H](c1c(cc(cc1)O)O)c1c(cc(c(c1)[C@@H]1O[C@@H]([C@H]([C@@H]1Cc1ccc(cc1)O)C(c1c(cc(cc1)O)O)=O)c1ccc(cc1)O)O)O)(=O)c1c(cc(cc1)O)O