input word = C00062005

Metabolite InformationStructural formula
Name beta-Sophorotriose
Formula C18H32O16
Mw 504.16903498
CAS RN 50906-47-3
C_ID C00062005
InChIKey -UQBIAGWOJDEOMN-OBEKGFCVSA-N
InChICode InChI=1S/C18H32O16/c19-1-4-8(23)11(26)14(16(29)30-4)33-18-15(12(27)9(24)6(3-21)32-18)34-17-13(28)10(25)7(22)5(2-20)31-17/h4-29H,1-3H2/t4-,5-,6-,7-,8-,9-,10+,11+,12+,13-,14-,15-,16-,17+,18+/m1/s1
SMILES OCC1OC(OC2C(OC3C(O)OC(CO)C(O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum tuberosum Ref.
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