input word = C00006546

Metabolite InformationStructural formula
Name 3,5,7,4',3'',5'',7''-Heptahydroxy-3'-O-4'''-biflavanone
Formula C30H22O12
Mw 574.11112617
CAS RN 144224-02-2
C_ID C00006546 ,
InChIKey HMHPBXXAPKCAFP-UHFFFAOYNA-N
InChICode InChI=1S/C30H22O12/c31-14-8-18(34)23-21(10-14)41-29(27(38)25(23)36)12-1-4-16(5-2-12)40-20-7-13(3-6-17(20)33)30-28(39)26(37)24-19(35)9-15(32)11-22(24)42-30/h1-11,27-35,38-39H/t27-,28+,29-,30-/m1/s1
SMILES c1cc(ccc1[C@H]1Oc2c(C(=O)[C@H]1O)c(cc(c2)O)O)Oc1c(ccc(c1)[C@H]1Oc2c(C(=O)[C@@H]1O)c(cc(c2)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypnaceaeHypnum cupressiforme Ref.
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