input word = C00046359

Metabolite InformationStructural formula
Name Rubiarbonol B
Formula C30H50O3
Mw 458.37599546
CAS RN 130288-60-7
C_ID C00046359 ,
InChIKey PZBGHZIQCYOWLL-VFOCVJHENA-N
InChICode InChI=1S/C30H50O3/c1-17(2)19-15-21(32)25-28(19,6)13-14-29(7)24-18(9-12-30(25,29)8)27(5)11-10-23(33)26(3,4)22(27)16-20(24)31/h9,17,19-25,31-33H,10-16H2,1-8H3/t19-,20-,21+,22-,23-,24-,25-,27+,28-,29-,30+/m0/s1
SMILES C1[C@@H](C([C@H]2[C@](C1)(C1=CC[C@]3([C@]([C@@H]1[C@H](C2)O)(CC[C@@]1([C@@H]3[C@@H](C[C@H]1C(C)C)O)C)C)C)C)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeRubia yunnanensis Ref.
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