input word = C00006751

Metabolite InformationStructural formula
Name Hirsutin
Formula C30H37O17
Mw 669.20307476
CAS RN 32221-58-2
C_ID C00006751 ,
InChIKey TVLYGBFZDPPZFR-NGRYYJFSNA-O
InChICode InChI=1S/C30H36O17/c1-40-12-6-14-13(15(7-12)44-29-26(38)24(36)22(34)19(9-31)46-29)8-18(45-30-27(39)25(37)23(35)20(10-32)47-30)28(43-14)11-4-16(41-2)21(33)17(5-11)42-3/h4-8,19-20,22-27,29-32,34-39H,9-10H2,1-3H3/p+1/t19-,20+,22+,23+,24-,25+,26-,27-,29+,30+/m0/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)c1cc(c(c(c1)OC)O)OC)O[C@H]1[C@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataePrunella vulgaris Ref.
PlantaePrimulaceaeDionysia archibaldii Ref.
PlantaePrimulaceaeDionysia bryoides Ref.
PlantaePrimulaceaeDionysia curviflora Ref.
PlantaePrimulaceaeDionysia microphylla Ref.
PlantaePrimulaceaePrimula cashmiriana Ref.
PlantaePrimulaceaePrimula rubra Ref.
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