input word = C00034956

Metabolite InformationStructural formula
Name Rabdoinflexin B
(-)-Rabdoinflexin B
Formula C20H30O5
Mw 350.20932407
CAS RN 125456-64-6
C_ID C00034956 ,
InChIKey CUJHFFISDMEILV-PLRBKKSKNA-N
InChICode InChI=1S/C20H30O5/c1-9-10-7-11(21)15-19(4)12(18(2,3)6-5-13(19)22)8-14(23)20(15,16(9)24)17(10)25/h10-15,17,21-23,25H,1,5-8H2,2-4H3/t10-,11-,12+,13-,14+,15-,17+,19-,20+/m0/s1
SMILES [C@H]1(O)[C@]23[C@@H](C[C@@H]4C(CC[C@@H]([C@]4([C@@H]2[C@H](C[C@H]1C(=C)C3=O)O)C)O)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon inflexa Ref.
PlantaeLabiataeIsodon phyllostachys Ref.
PlantaeLabiataeIsodon scoparius Ref.
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