ID: 48889
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(OC)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.024
InChIKey:MVRKTZAGCVMDGH-UHFFFAOYSA-N
ID: 48890
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CCC(O)(C)C12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.656
InChIKey:NAUZBUFMQFLJEH-UHFFFAOYSA-N
ID: 48891
SMILES:c1(O)c(CCC)cc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.844
InChIKey:BCZUMXLRUXLYED-UHFFFAOYSA-N
ID: 48892
SMILES:C(CCCCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)=C1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.811
InChIKey:VCHDCEMUFNTRBO-UHFFFAOYSA-N
ID: 48893
SMILES:C12CC(C)(O)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 48894
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 48895
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -16.481
InChIKey:YGQOYJUFZSNESF-UHFFFAOYSA-N
ID: 48896
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 48897
SMILES:OC1C(c2c(O)cc(CCC)cc2O)CC(C)=CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -15.128
InChIKey:VVLSPSJUBPWWFY-UHFFFAOYSA-N
ID: 48898
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(cc(CCCCC)c(O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.996
InChIKey:XXGMIHXASFDFSM-UHFFFAOYSA-N
ID: 48899
SMILES:C(CCCCCCC)CCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -15.783
InChIKey:GGPZODGSFUJDBF-UHFFFAOYSA-N
ID: 48900
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.51
InChIKey:LVQZQKXEEYFSQO-UHFFFAOYSA-N
ID: 48901
SMILES:c1(C=O)c(O)c(C2C(C(C)(C)O)CCC(C)=C2)c(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.635
InChIKey:PJHQUZCHLVLIOJ-UHFFFAOYSA-N
ID: 48902
SMILES:c1(CCCC)c(C)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.17
InChIKey:ZHPUQSIMTYDTKX-UHFFFAOYSA-N
ID: 48903
SMILES:C1(C)=CCCC(C)CC2C(CC1)C(C)(C)Oc1c2c(O)cc(CC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.039
InChIKey:SYYZIMGVBAQLFJ-UHFFFAOYSA-N
ID: 48904
SMILES:C1C2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 48905
SMILES:c1c(CCCCC)cc(O)c2c1OC1C2C(C)C(C)CO1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -14.001
InChIKey:WSTGLBPYVXSXET-UHFFFAOYSA-N
ID: 48906
SMILES:c12c(c(O)c(C(=O)C(C)C)cc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.071
InChIKey:OYXBGRCDFHLVTE-UHFFFAOYSA-N
ID: 48907
SMILES:C1CC(Oc2c(O)cc(C)c(Cl)c2C)C(C)(C)OC1(C)C(OC(C(C)CC)=O)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.98
CB1 binding score: -14.821
InChIKey:XXFNMPUGJXMVGO-UHFFFAOYSA-N
ID: 48908
SMILES:C(c1cc(OC)c2c(c1)OC(C)(C)C1CCC(C)=CC21)C(=O)OCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.087
InChIKey:IQDBJZSTIFZBCG-UHFFFAOYSA-N
ID: 48909
SMILES:COC(=O)C1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N