input word = C00051620

Metabolite InformationStructural formula
Name Mollugogenol A
Formula C30H52O4
Mw 476.38656015
CAS RN 22550-76-1
C_ID C00051620
InChIKey USLXSBTYECTZSS-HNNIDLQRNA-N
InChICode InChI=1S/C30H52O4/c1-25(2)22(33)12-14-28(6)21-10-9-20-27(5)13-11-17(26(3,4)34)23(27)18(31)15-29(20,7)30(21,8)16-19(32)24(25)28/h17-24,31-34H,9-16H2,1-8H3/t17-,18+,19+,20-,21-,22+,23-,24+,27-,28-,29-,30-/m1/s1
SMILES CC(C)(O)[C@@H]1CC[C@@]2(C)[C@H]1[C@@H](O)C[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O)C[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMolluginaceaeMollugo pentaphylla Ref.
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