ID: 122683
SMILES:c1(CC=C(CCC=C(C)COC(C)=O)c2c(O)cc(CCCC)cc2OC)OC(C)(C)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -16.228
InChIKey:AYZLHUUMVOADFN-UHFFFAOYSA-N
ID: 122684
SMILES:O1C2(C)C(O)CC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.605
InChIKey:DRYPVRUNYWFANR-UHFFFAOYSA-N
ID: 122685
SMILES:c1(O)cc(OC)c2c(c1CC=C(C)C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.166
InChIKey:KSOPSHXBMOJIAF-UHFFFAOYSA-N
ID: 122686
SMILES:CC1=CC2c3c(cc(C(=NOC)C(C)C)c(O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 359.466
CB1 binding score: -15.717
InChIKey:LUMQHIGKBRSOFW-UHFFFAOYSA-N
ID: 122687
SMILES:c12c(ccc(CCCCCC)n1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -14.899
InChIKey:LHFWGUOPLVDVQW-UHFFFAOYSA-N
ID: 122688
SMILES:N(C(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC)C)(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 373.581
CB1 binding score: -13.328
InChIKey:OLLQWTALTDAZMC-UHFFFAOYSA-N
ID: 122689
SMILES:C(CCc1cc(O)c2c(c1)OC1(C)CCC(C(C)C)C1C2C(=O)O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.254
InChIKey:DKURVGGZWFMMNC-UHFFFAOYSA-N
ID: 122690
SMILES:c1(CCCCCCC)c(C(O)=O)cc(O)c(CC=C(C)CCC=C(C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.429
InChIKey:XDVYXWCMFFDDBF-UHFFFAOYSA-N
ID: 122691
SMILES:C1C(C)=CC(c2c(O)c(CC=C(CCC=C(C)C)C)c(O)c(C(=O)CCCCC)c2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.717
CB1 binding score: -12.596
InChIKey:YRHFEKIBTVRHFD-UHFFFAOYSA-N
ID: 122692
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 122693
SMILES:Oc1cc(CCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 122694
SMILES:C1(=C)C2(C)CCC(C)C(C)(c3c(O)cc(CCCC)cc3O)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.425
InChIKey:KIERMVNNHMEEJR-UHFFFAOYSA-N
ID: 122695
SMILES:CC1C(c2c(O)cc(CCCCC)cc2OC)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -18.04
InChIKey:VWPDKWYLHYLRFP-UHFFFAOYSA-N
ID: 122696
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C=C(C)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.954
InChIKey:GTFBHIJOEJKPMM-UHFFFAOYSA-N
ID: 122697
SMILES:c1(C)cc(OC)c(O)c(C2C(C(=C)C)CC3(C)CCC=C(C)C3C2=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.265
InChIKey:JAMZZKFAZXXLPU-UHFFFAOYSA-N
ID: 122698
SMILES:C1CCC(C(C)C)C2C1(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.196
InChIKey:KPHQHZWTRLIJMP-UHFFFAOYSA-N
ID: 122699
SMILES:CC(CC(=O)CC1(C)CCC(C(C(c2c(O)cc(CCCCC)cc2O)=O)=O)C(=O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -17.346
InChIKey:WCXFDRYFLPDCTG-UHFFFAOYSA-N
ID: 122700
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC2C(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.734
InChIKey:VOOGUTSNGSRJHQ-UHFFFAOYSA-N
ID: 122701
SMILES:OC1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.955
InChIKey:UKTDGUHOBZBFHV-UHFFFAOYSA-N
ID: 122702
SMILES:C12C3C(C)(C)Oc4cc(CCCCC)cc(c43)C(CCC1(C)O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.379
InChIKey:VNSRZLORORGVQL-UHFFFAOYSA-N
ID: 122703
SMILES:C1(=O)c2c(OC)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.81
InChIKey:HNWKMGXBZNCDAK-UHFFFAOYSA-N