input word = C00006525

Metabolite InformationStructural formula
Name Hypnumbiflavonoid B
Formula C30H22O12
Mw 574.11112617
CAS RN 144224-03-3
C_ID C00006525 ,
InChIKey HYVXHSSJVFRMAO-UHFFFAOYNA-N
InChICode InChI=1S/C30H22O12/c31-12-3-4-30(29-27(39)25(37)23-17(35)7-14(33)9-20(23)42-29)15-5-11(1-2-18(15)40-21(30)10-12)28-26(38)24(36)22-16(34)6-13(32)8-19(22)41-28/h1-9,21,26-29,32-35,38-39H,10H2/t21-,26-,27+,28+,29-,30+/m1/s1
SMILES c1c2c(ccc1[C@@H]1Oc3c(C(=O)[C@H]1O)c(cc(c3)O)O)O[C@H]1[C@]2([C@H]2[C@H](C(=O)c3c(cc(cc3O2)O)O)O)C=CC(=O)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypnaceaeHypnum cupressiforme Ref.
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