input word = C00040977

Metabolite InformationStructural formula
Name Glabcensin N
(-)-Glabcensin N
Formula C30H42O11
Mw 578.27271219
CAS RN 196607-59-7
C_ID C00040977 ,
InChIKey ZDHNGQWYWBNSEU-OXGILZTGNA-N
InChICode InChI=1S/C30H42O11/c1-13-19-10-20(37-14(2)31)23-29(9)12-21(38-15(3)32)26(40-17(5)34)28(7,8)24(29)22(39-16(4)33)27(41-18(6)35)30(23,11-19)25(13)36/h19-27,36H,1,10-12H2,2-9H3/t19-,20+,21+,22-,23+,24-,25-,26+,27+,29+,30+/m1/s1
SMILES C=C1[C@@H]2C[C@H](OC(C)=O)[C@H]3[C@]4(C)C[C@H](OC(C)=O)[C@H](OC(C)=O)C(C)(C)[C@H]4[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]3(C2)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon angustifolius var. glabrescens Ref.
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