input word = C00050915

Metabolite InformationStructural formula
Name Isodonadenanthin
Formula C30H44O6
Mw 500.31378914
CAS RN 833489-55-7
C_ID C00050915
InChIKey RAXRYLWYBYPISI-LMAVXIMINA-N
InChICode InChI=1S/C30H44O6/c1-15-7-10-29-12-11-28(6)27(5)9-8-18-25(3,13-17(32)22(33)26(18,4)14-31)21(27)19-23(35-19)30(28,36-24(29)34)20(29)16(15)2/h16-23,31-33H,1,7-14H2,2-6H3/t16-,17+,18+,19-,20+,21+,22-,23-,25-,26+,27+,28-,29-,30+/m0/s1
SMILES C=C1CC[C@@]23CC[C@]4(C)[C@@](OC2=O)([C@@H]3[C@H]1C)[C@H]1O[C@H]1[C@@H]1[C@@]2(C)C[C@@H](O)[C@H](O)[C@](C)(CO)[C@@H]2CC[C@]14C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLamiaceaeRabdosia adenantha Ref.
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