input word = C00042672

Metabolite InformationStructural formula
Name Lanceolitol B5
Formula C30H56O12
Mw 608.37717725
CAS RN 862699-54-5
C_ID C00042672 ,
InChIKey YIKVPKTVJAIMRX-FTEAZDPFNA-N
InChICode InChI=1S/C30H56O12/c1-3-4-5-6-8-11-14-18(2)15-12-9-7-10-13-16-20(32)41-28-25(37)23(35)24(36)26(38)29(28)42-30-27(39)22(34)21(33)19(17-31)40-30/h18-19,21-31,33-39H,3-17H2,1-2H3/t18-,19+,21+,22-,23-,24+,25-,26+,27+,28-,29+,30-/m0/s1
SMILES [C@@H]1([C@H]([C@H]([C@H]([C@H]([C@H]1OC(=O)CCCCCCC[C@H](CCCCCCCC)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum lanceolatum Ref.
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