(Q27137906)

Lobophytumin E (English)

7 October 2016

chemical formula

C₂₀H₃₀O

1 reference

Lobophytumin E (English)

7 October 2016

canonical SMILES

CC(CC(=O)C=C(C)C)C1CCC2(C1C3C2CCC3=C)C

1 reference

Lobophytumin E (English)

7 October 2016

isomeric SMILES

CC(CC(=O)C=C(C)C)[C@H]1CC[C@@]2([C@H]1[C@@H]3[C@H]2CCC3=C)C

1 reference

Lobophytumin E (English)

InChI=1S/C20H30O/c1-12(2)10-15(21)11-14(4)16-8-9-20(5)17-7-6-13(3)18(17)19(16)20/h10,14,16-19H,3,6-9,11H2,1-2,4-5H3/t14?,16-,17-,18+,19-,20+/m1/s1

7 October 2016

Identifiers

InChI

1 reference

Lobophytumin E (English)

QCUYCSJANBKKLA-CIQMHLMDSA-N

7 October 2016

InChIKey

2 references

Lobophytumin E (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2-Methyl-6-[(1R,3aS,3bR,6aS,6bR)-3a-methyl-6-methylenedecahydrocyclopenta[3,4]cyclobuta[1,2]cyclopenten-1-yl]-2-hepten-4-one (English)

7 October 2016

1 reference

Lobophytumin E (English)

7 October 2016

Reaxys registry number

21975509

1 reference

lobophytumin E (English)

7 October 2016

ChEBI ID

69563

mapping relation type

1 reference