input word = C00049298

Metabolite InformationStructural formula
Name Scuteselerin
(-)-Scuteselerin
Formula C29H40O10
Mw 548.2621475
CAS RN 202343-92-8
C_ID C00049298 ,
InChIKey ACWKUJGPFSGZLI-VDSKIOFQNA-N
InChICode InChI=1S/C29H40O10/c1-15(2)11-21(32)38-25-24(34)26(6)16(3)9-10-19(36-17(4)30)23(26)27(7)20(37-18(5)31)12-29(39-28(25,27)8)13-22(33)35-14-29/h11,19-20,23-25,34H,3,9-10,12-14H2,1-2,4-8H3/t19-,20+,23+,24+,25+,26+,27-,28+,29-/m1/s1
SMILES [C@H]1([C@]2([C@@](O[C@]3(C1)CC(=O)OC3)([C@H]([C@@H]([C@@]1([C@@H]2[C@@H](CCC1=C)OC(=O)C)C)O)OC(=O)C=C(C)C)C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeScutellaria seleriana Ref.
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