input word = C00037383

Metabolite InformationStructural formula
Name Khekadaengoside L
(-)-Khekadaengoside L
Formula C34H48O13
Mw 664.30949162
CAS RN 415711-12-5
C_ID C00037383 ,
InChIKey UVTOZNBQQNBPDH-VATKNGBMNA-N
InChICode InChI=1S/C34H48O13/c1-14-22(38)24(40)26(42)29(44-14)47-27-25(41)23(39)19(13-35)46-30(27)45-18-9-17-16(31(2,3)28(18)43)7-8-20-33(5)11-15(36)10-32(33,4)12-21(37)34(17,20)6/h7,9,14,17,19-20,22-27,29-30,35,38-42H,8,10-13H2,1-6H3/t14-,17+,19+,20-,22-,23+,24+,25-,26+,27+,29-,30+,32-,33-,34-/m0/s1
SMILES C1(=C[C@@H]2C(=CC[C@@H]3[C@]2(C(=O)C[C@]2([C@]3(CC(=O)C2)C)C)C)C(C1=O)(C)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCucurbitaceaeTrichosanthes tricuspidata Ref.
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OrganismTrichosanthes tricuspidata
ReferenceKanchanapoom,Phytochem.,59,(2002),215