input word = C00003096

Metabolite InformationStructural formula
Name Plumieride
Formula C21H26O12
Mw 470.1424263
CAS RN 511-89-7
C_ID C00003096 ,
InChIKey AOPMSFXOYJXDNJ-DSBGFTIHNA-N
InChICode InChI=1S/C21H26O12/c1-8(23)10-5-21(33-18(10)28)4-3-9-11(17(27)29-2)7-30-19(13(9)21)32-20-16(26)15(25)14(24)12(6-22)31-20/h3-5,7-9,12-16,19-20,22-26H,6H2,1-2H3/t8-,9-,12-,13+,14-,15-,16+,19-,20-,21+/m0/s1
SMILES [C@H]1([C@@H]([C@H]([C@@H](O[C@H]1CO)O[C@@H]1OC=C([C@H]2[C@H]1[C@]1(C=C2)OC(=O)C(=C1)[C@@H](O)C)C(=O)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApocynaceaePlumeria acutifolia Ref.
PlantaeApocynaceaePlumeria rubra Ref.
PlantaeApocynaceaePlumeria spp. Ref.
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OrganismPlumeria acutifolia
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter49