input word = C00054671

Metabolite InformationStructural formula
Name Aldobiouronic acid D3
Formula C11H18O11
Mw 326.08491142
CAS RN 17676-51-6
C_ID C00054671
InChIKey CXXAVRBGWUSLRR-MHNDCQGXSA-N
InChICode InChI=1S/C11H18O11/c12-1-3(14)5(15)4(2-13)21-11-8(18)6(16)7(17)9(22-11)10(19)20/h2-9,11-12,14-18H,1H2,(H,19,20)/t3-,4+,5+,6+,7+,8-,9+,11+/m1/s1
SMILES O=C[C@H](O[C@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H](O)[C@H](O)CO
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBromeliaceaePuya spp. Ref.
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OrganismPuya spp.
ReferenceJones, J.K.N. et al., JCS, 1952, 2750

, 3389

1957, 669

1958, , 1059 (isol, 4'-Me)