input word = C00006595

Metabolite InformationStructural formula
Name Lophirachalcone
Lophirochalcone
Formula C60H48O15
Mw 1008.29932087
CAS RN 122585-40-4
C_ID C00006595 ,
InChIKey HUSLZNYNWSUNJK-IJRUSZDXNA-N
InChICode 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
SMILES c12c(ccc(c1)/C=C/C(=O)c1ccc(cc1O)O)O[C@H]([C@@H]2[C@@H](c1cc(c(cc1O)O)[C@H]1[C@H]([C@H]([C@H](O1)c1ccc(cc1)O)C(=O)c1c(cc(cc1)O)O)Cc1ccc(cc1)O)c1c(cc(cc1)O)O)c1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeOchnaceaeLophira lanceolata Ref.
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