ID: 72892
SMILES:C(C)CCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 72893
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(O)cc(Cl)c32)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.762
CB1 binding score: -14.901
InChIKey:BALWZNPFYOOAKN-UHFFFAOYSA-N
ID: 72894
SMILES:C1(C)C2(C)c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.67
InChIKey:SROHMMRDFZZTGF-UHFFFAOYSA-N
ID: 72895
SMILES:C(Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2)(=O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.809
InChIKey:CQXNRWIOLVXVNA-UHFFFAOYSA-N
ID: 72896
SMILES:O(c1c(O)c(OC)cc(CCCCC)c1)CC=C(CCC=C(CCC=C(C)C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -16.092
InChIKey:NAGHPWYMVXROQB-UHFFFAOYSA-N
ID: 72897
SMILES:CC1(C)C2C(C=C(C)CC2)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 72898
SMILES:C1=C(C)CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 72899
SMILES:C1=C(CO)CCC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.246
InChIKey:HRMWQEIOKVXWLQ-UHFFFAOYSA-N
ID: 72900
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.568
InChIKey:JXULCRXRUMSDJX-UHFFFAOYSA-N
ID: 72901
SMILES:C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -17.752
InChIKey:XOAHTHGPQALFJE-UHFFFAOYSA-N
ID: 72902
SMILES:c1c(O)c(C)cc2c1C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 72903
SMILES:O(C)c1c2c(c(C(CC(C)=CCc3c(O)c(C)cc(OC)c3)O)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.655
CB1 binding score: -12.659
InChIKey:KZONABSSFAKDRH-UHFFFAOYSA-N
ID: 72904
SMILES:c1(CCCC)cc2c(c(O)c1)C1OC(=O)C3(CCC(O)C3(C)C)C1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -14.654
InChIKey:ZRNVFYTVHTZIMO-UHFFFAOYSA-N
ID: 72905
SMILES:C(C)(C)C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 72906
SMILES:c12c(c(O)cc(C)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 72907
SMILES:C(C)CCCc1cc2c(c(O)c1)C1OCOC1CC(c1ccc(C(O)=O)cc1)C(CCC)C(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.573
CB1 binding score: -15.596
InChIKey:KAKLEWBNBGXLJY-UHFFFAOYSA-N
ID: 72908
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 72909
SMILES:O(C1C2C(CCC=C(C)C)(C)C(c3c(O)cc(CCCCC)cc31)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.605
InChIKey:SBOJYPPELKSWSE-UHFFFAOYSA-N
ID: 72910
SMILES:O(c1c(C2C=C(C)CCC2C(=C)C)cccc1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 72911
SMILES:CC1(O)C2C(O)(c3c(O)cc(CCCCC)cc3O2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.121
InChIKey:JKFAUUXFYAWDHJ-UHFFFAOYSA-N
ID: 72912
SMILES:CC1C2(C(C)=CCC3C(C)(C)CC23)Oc2c1c(O)c(O)c(C(CCCCCCCC)CO)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.133
InChIKey:PAPQZHBNZVVNQA-UHFFFAOYSA-N