rel-(1R,2E,4R,7E,11S,12R)-2,7,18-Dolabellatriene (Q27138299)

CID51040259 (English)

(1R,3aR,4E,6S,9E,12aS)-3a,6,10-trimethyl-1-prop-1-en-2-yl-2,3,6,7,8,11,12,12a-octahydro-1H-cyclopenta[11]annulene

7 October 2016

stereoisomer of

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂

1 reference

CID51040259 (English)

7 October 2016

canonical SMILES

CC1CCC=C(CCC2C(CCC2(C=C1)C)C(=C)C)C

1 reference

CID51040259 (English)

7 October 2016

isomeric SMILES

C[C@@H]\1CC/C=C(/CC[C@H]2[C@@H](CC[C@@]2(/C=C1)C)C(=C)C)\C

1 reference

Dolabellanes with antibacterial activity from the brown alga Dilophus spiralis

CID51040259 (English)

7 October 2016

1 reference

Identifiers

InChI

InChI=1S/C20H32/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,11,13,17-19H,1,6,8-10,12,14H2,2-5H3/b13-11+,16-7+/t17-,18+,19+,20+/m1/s1

1 reference

CID51040259 (English)

DQSHCYDPVQKJSC-IAGGUBJBSA-N

7 October 2016

InChIKey

2 references

CID51040259 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(3R,3aS,10R,11E,12aR)-3-Isopropenyl-6,10,12a-trimethyl-1,2,3,3a,4,5,8,9,10,12a-decahydrocyclopenta[11]annulene (English)

7 October 2016

2 references

CID51040259 (English)

matched by identifier from

7 October 2016

InChIKey

DQSHCYDPVQKJSC-IAGGUBJBSA-N

ChEBI ID

69955

mapping relation type

2 references

rel-(1R,2E,4R,7E,11S,12R)-2,7,18-Dolabellatriene (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C20H32/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,11,13,17-19H,1,6,8-10,12,14H2,2-5H3/b13-11+,16-7+/t17-,18+,19+,20+/m1/s1

1 reference