input word = C00048018

Metabolite InformationStructural formula
Name Nervosanin B
Formula C20H30O6
Mw 366.20423869
CAS RN 40768-50-1
C_ID C00048018 ,
InChIKey DSHJJLKUJOADCV-QWMPLALDNA-N
InChICode InChI=1S/C20H30O6/c1-9-10-6-11(21)13-18-8-26-20(25,19(13,7-10)15(9)23)16(24)14(18)17(2,3)5-4-12(18)22/h10-16,21-25H,1,4-8H2,2-3H3/t10-,11-,12+,13+,14-,15-,16+,18+,19+,20-/m1/s1
SMILES C=C1[C@@H]2C[C@@H](O)[C@H]3[C@@]45CO[C@](O)([C@@H](O)[C@@H]4C(C)(C)CC[C@@H]5O)[C@]3(C2)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon sculponeatus Ref.
PlantaeLamiaceaeRabdosia nervosa Ref.
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OrganismRabdosia nervosa
ReferenceSun, et al., Diterpenoids from Isodon Species, Science Press, Beijing, (2001)