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=C1C(=O)[C@]23C[C@H]1C[C@H](OC(C)=O)[C@H]2[C@@]1(C)[C@H]([C@@H](OC(C)=O)[C@@H]3OC(C)=O)C(C)(C)[C@@H](OC(C)=O)C[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon melissoides Ref.
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