ID: 34903
SMILES:C1(=C)OC(C)(C)C2C(c3c(O)cc(CCC)cc3O)CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.776
InChIKey:RWWSQJGHGGCMLN-UHFFFAOYSA-N
ID: 34904
SMILES:c1c(CCCC)cc2c(c1O)C1=C(C(O)=C(C)C(=O)C1(C)C)C(C=C(C)CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: -13.904
InChIKey:ONXPTSAUHVKLRY-UHFFFAOYSA-N
ID: 34905
SMILES:C(CC(=CCc1cc(O)cc(CCCCCC)c1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.566
InChIKey:DBGDJEPGHVPSEJ-UHFFFAOYSA-N
ID: 34906
SMILES:C1c2c(cc(CCCCC)cc2O)OC(C)(C)C2C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.951
InChIKey:CSAQQDLBKSCGOR-UHFFFAOYSA-N
ID: 34907
SMILES:C1C(C)=CC(=O)C2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -16.853
InChIKey:XBHAYMZVVIBAMR-UHFFFAOYSA-N
ID: 34908
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C)(C)C2CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.563
CB1 binding score: -14.562
InChIKey:PLPKHJCHYUNISY-UHFFFAOYSA-N
ID: 34909
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C(=O)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.745
InChIKey:VRZWHTKBFZGYJJ-UHFFFAOYSA-N
ID: 34910
SMILES:C(CC=C)Cc1cc2c(c(O)c1)C1C(C(O)(C)C)CCC(O)(C)C1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.988
InChIKey:WFABHXBDXQKCCA-UHFFFAOYSA-N
ID: 34911
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)Cc1cc(O)c(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -14.435
InChIKey:BIVXBVCZOXMDEQ-UHFFFAOYSA-N
ID: 34912
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C(C(O)(C)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.652
InChIKey:CUGBKCCALZDOGW-UHFFFAOYSA-N
ID: 34913
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 34914
SMILES:C(Cc1cc(C2C=C(C)CCC2C(=C)C)c(O)c(C=O)c1OC)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.614
InChIKey:HQPRBBDNIUKAKI-UHFFFAOYSA-N
ID: 34915
SMILES:c1(C(=O)C=C(C)C)c(C(O)=O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -14.639
InChIKey:NWEFJFFQKGPPHA-UHFFFAOYSA-N
ID: 34916
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC=C(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 34917
SMILES:C1CC(C)(C)C2C(C)(C1)Oc1c(c(O)cc(CCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 288.431
CB1 binding score: -18.4
InChIKey:IYJFZOBKCYBWAD-UHFFFAOYSA-N
ID: 34918
SMILES:O(C(C(C(OC(=O)C)CC)=O)C(c1ccccc1)c1c(C)c2c(c(C(=O)OC)c1)OC(C)(C)C1C2C=C(C)CC1)CCCCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 618.811
CB1 binding score: -15.317
InChIKey:MTXXBYANIXYINV-UHFFFAOYSA-N
ID: 34919
SMILES:C(=O)(OCCCC)CCc1cc2c(c(O)c1)C1CC(C(C)=C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.426
InChIKey:DSFVUQZAKPMPAH-UHFFFAOYSA-N
ID: 34920
SMILES:C(CCCC)c1cc(O)cc2c1C(=O)OC(C=CC=C(C)CCC=C(C)C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.847
InChIKey:JLTJMMSFODUQMS-UHFFFAOYSA-N
ID: 34921
SMILES:C(CCCc1cc(O)c(CC=C(C)CCC=C(C)C)c2c1C(=O)C1CC=C(C)C21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -16.36
InChIKey:KBEDFXNPGRPTBO-UHFFFAOYSA-N
ID: 34922
SMILES:c1(O)c2c(cc(O)c1C(C(=C)CCC=C(C)C)O)OC(C)(C)C1C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -11.657
InChIKey:OSCKCGSCYBWSOH-UHFFFAOYSA-N
ID: 34923
SMILES:c1(CC=O)c(O)cc(CC=C(CCC=C(C)C)C)c(O)c1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -14.912
InChIKey:NHDVAHPHGPTGTD-UHFFFAOYSA-N