input word = C00046360

Metabolite InformationStructural formula
Name Rubiarbonol G
Formula C32H52O5
Mw 516.38147477
CAS RN 142778-14-1
C_ID C00046360 ,
InChIKey IPFJEJXCPFOYQR-CFZLPUJYNA-N
InChICode InChI=1S/C32H52O5/c1-18(2)21-15-23(37-19(3)34)27-31(8)12-9-20-26(30(31,7)13-14-32(21,27)17-33)22(35)16-24-28(4,5)25(36)10-11-29(20,24)6/h9,18,21-27,33,35-36H,10-17H2,1-8H3/t21-,22-,23+,24+,25-,26-,27+,29+,30-,31+,32+/m0/s1
SMILES CC(=O)O[C@@H]1C[C@@H](C(C)C)[C@]2(CO)CC[C@@]3(C)[C@H]4C(=CC[C@]3(C)[C@@H]12)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1C[C@@H]4O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRubiaceaeRubia yunnanensis Ref.
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