input word = C00048991

Metabolite InformationStructural formula
Name Gesneroidin C
(-)-Gesneroidin C
Formula C28H38O10
Mw 534.24649744
CAS RN 170971-42-3
C_ID C00048991 ,
InChIKey VFIFMJYWVUYCHB-BZWSRRAKNA-N
InChICode InChI=1S/C28H38O10/c1-12-17-9-18(35-13(2)29)22-27(8)19(33)10-20(36-14(3)30)26(6,7)23(27)21(37-15(4)31)25(38-16(5)32)28(22,11-17)24(12)34/h17-23,25,33H,1,9-11H2,2-8H3/t17-,18+,19+,20+,21-,22+,23-,25+,27+,28+/m1/s1
SMILES [C@H]1([C@@H]2[C@]3(C[C@@H](C1)C(=C)C3=O)[C@H]([C@@H]([C@H]1[C@]2([C@H](C[C@@H](C1(C)C)OC(=O)C)O)C)OC(=O)C)OC(=O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon melissoides Ref.
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