ID: 36772
SMILES:C(C1C(Cc2c(O)cc(CCCCC)cc2)=C(C)CCC1C(=C)C)#N
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.507
CB1 binding score: -15.652
InChIKey:YFLSBLPCHLGMRT-UHFFFAOYSA-N
ID: 36773
SMILES:CC12C(O)Oc3cc(CCCCC)cc4c3C(C(=C)CC4)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.565
InChIKey:LBHDXIUXNHEJTF-UHFFFAOYSA-N
ID: 36774
SMILES:Oc1cc(CC)cc(O)c1CC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 36775
SMILES:O(c1c(CC=C(C)C)c(O)cc(CCCCC)c1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -19.169
InChIKey:FCNLMUQPSJEBQE-UHFFFAOYSA-N
ID: 36776
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 36777
SMILES:c1(O)c2c(cc(C(O)(C)CCC=C(C)C)c1)OC(C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.929
InChIKey:GPXFTBZXQMYRIJ-UHFFFAOYSA-N
ID: 36778
SMILES:C(C(C)=CCc1c(O)c(C(=O)O)c(CCCCC)c(OC)c1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -17.799
InChIKey:ACTRNDNUMZFQSX-UHFFFAOYSA-N
ID: 36779
SMILES:C12(CO)c3c(cc(CCCCC)c(O)c3O)OC(C)(C)C1CC(C(=O)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.011
InChIKey:HPQPKYNYUZZPQX-UHFFFAOYSA-N
ID: 36780
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1C(C)(CCCC1C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -17.454
InChIKey:PYXDOLPCFKZBKW-UHFFFAOYSA-N
ID: 36781
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 36782
SMILES:OCC1(C)OC(=O)CC23C(O)c4c(cc(C)cc4O)C2OC(C)(C)C3CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.449
CB1 binding score: -15.178
InChIKey:UMNUXCWHSVSKFH-UHFFFAOYSA-N
ID: 36783
SMILES:C(=Cc1c(O)cc(O)c2c1OC(C)(C)C1CC=C(C)CC12)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.756
InChIKey:OKFNUJGOTYECBV-UHFFFAOYSA-N
ID: 36784
SMILES:C(C(CCCC)c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: Not available
InChIKey:OBRPSBAVYHOKEX-UHFFFAOYSA-N
ID: 36785
SMILES:C(C)(C1C(c2c(O)cc(CCCC)cc2O)CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.334
InChIKey:UOQAQJLARPRUBJ-UHFFFAOYSA-N
ID: 36786
SMILES:C(=C(C)CCC=C(C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.313
InChIKey:RZTPKEWZQHLMRT-UHFFFAOYSA-N
ID: 36787
SMILES:C(Cc1c(C)c(Cl)c(O)c2c1OC(C)(C)C1CCC(C)=CC12)(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.898
CB1 binding score: -14.139
InChIKey:OFCWBEIVELGKMD-UHFFFAOYSA-N
ID: 36788
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 36789
SMILES:Oc1cc(CCc2ccccc2)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -16.521
InChIKey:KWQKEIYAUXPTSL-UHFFFAOYSA-N
ID: 36790
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 36791
SMILES:C12C(CCC1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.029
InChIKey:HCVJHHUJBXZYBI-UHFFFAOYSA-N
ID: 36792
SMILES:C(CCCCC)c1cc2c(c(O)c1)C1=C(C(=O)OC)C3C(CC(C)C)C=C(C)C3OC1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -12.449
InChIKey:AXMKFKWOYICGST-UHFFFAOYSA-N