(Q27132745)

syn-labda-8(17),12E,14-triene (English)

(12Z)-Labda-8(20),12,14-triene

7 October 2016

stereoisomer of

2 references

inferred from InChIKey

(4aS,8R,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2Z)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene

inferred from InChI

2 references

(12E)-labda-8(17),12,14-triene

inferred from InChIKey

1 reference

1 reference

(4aR,8S,8aS)-4,4,8a-trimethyl-7-methylidene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene

inferred from InChI

1 reference

1 reference

C₂₀H₃₂

1 reference

syn-labda-8(17),12E,14-triene (English)

7 October 2016

canonical SMILES

CC(=CCC1C(=C)CCC2C1(CCCC2(C)C)C)C=C

1 reference

syn-labda-8(17),12E,14-triene (English)

7 October 2016

isomeric SMILES

C/C(=C\C[C@@H]1C(=C)CC[C@@H]2[C@@]1(CCCC2(C)C)C)/C=C

1 reference

syn-labda-8(17),12E,14-triene (English)

InChI=1S/C20H32/c1-7-15(2)9-11-17-16(3)10-12-18-19(4,5)13-8-14-20(17,18)6/h7,9,17-18H,1,3,8,10-14H2,2,4-6H3/b15-9+/t17-,18+,20-/m1/s1

7 October 2016

Identifiers

InChI

1 reference

syn-labda-8(17),12E,14-triene (English)

VJVMMXUPZGOBSN-URKRXPPWSA-N

7 October 2016

InChIKey

2 references

syn-labda-8(17),12E,14-triene (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

syn-labda-8(17),12E,14-triene (English)

7 October 2016

2 references

syn-labda-8(17),12E,14-triene (English)

matched by identifier from

7 October 2016

InChIKey

VJVMMXUPZGOBSN-URKRXPPWSA-N

Reaxys registry number

22213063

1 reference

syn-labda-8(17),12E,14-triene (English)

7 October 2016

ChEBI ID

63707

mapping relation type

2 references

syn-labda-8(17),12E,14-triene (English)