ID: 35491
SMILES:C1(C(=C)C)CCC(Cc2cc(CCC)cc(O)c2O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -13.952
InChIKey:VWOZRWJQORZHFC-UHFFFAOYSA-N
ID: 35492
SMILES:C(OCC1Cc2c(cc(CCCCC)cc2O)OC1=O)C1=C(C)OC(=O)C(=C(C)C(OC)=O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.534
CB1 binding score: -13.403
InChIKey:VEZJPPLEVQTBKY-UHFFFAOYSA-N
ID: 35493
SMILES:O=C(CCCO)OCC(=O)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -17.1
InChIKey:LAGLSHQGDIOTAT-UHFFFAOYSA-N
ID: 35494
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(CO)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.712
InChIKey:OBXUHTSWUPLSDQ-UHFFFAOYSA-N
ID: 35495
SMILES:c1(CCCCC)cc2c(c(O)c1C(O)=O)OC(C)(C)C1CC=C(CO)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.842
InChIKey:LEFXQOADIBZQFN-UHFFFAOYSA-N
ID: 35496
SMILES:CCC(c1c(N)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.413
CB1 binding score: -15.558
InChIKey:AQIFTWCZWOKEFB-UHFFFAOYSA-N
ID: 35497
SMILES:C1C=C(C)C(C(=O)OCc2ccc(CCCC)cc2)C2C(C(=C)C)CCC12C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -14.627
InChIKey:FYFVLAPNRPKIOJ-UHFFFAOYSA-N
ID: 35498
SMILES:CC1(C)C2CCC(C)=CC2c2c1cc(CCCCC)cc2O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -19.594
InChIKey:GBBIYEKUPBZPNQ-UHFFFAOYSA-N
ID: 35499
SMILES:C(C(C1=C(C(C)C(=O)C)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1)C)CC(C(C)=C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -15.215
InChIKey:BUTMKSNHZYLECJ-UHFFFAOYSA-N
ID: 35500
SMILES:CCCCCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 35501
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.479
InChIKey:QHFVULIOBFWRAD-UHFFFAOYSA-N
ID: 35502
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(CO)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 35503
SMILES:C1C(CCCC(CO)C)(C)Oc2cc(C)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.577
InChIKey:TTYDWGBXKHYGFS-UHFFFAOYSA-N
ID: 35504
SMILES:c1c(CCCCCC)cc2c(c1O)C1C(O2)C(O)(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.195
InChIKey:HCAHPGZYSHQZKS-UHFFFAOYSA-N
ID: 35505
SMILES:Oc1c(C(NCCS)=O)cc(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 347.48
CB1 binding score: -14.985
InChIKey:QHKCDHKAJXMAQV-UHFFFAOYSA-N
ID: 35506
SMILES:C=C1CCC(C(C)C)C(c2c(O)cc(CCCCCO)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.032
InChIKey:VHBVYKVOSMRUJN-UHFFFAOYSA-N
ID: 35507
SMILES:c1(C(C2=C(O)C3(Oc4c(CC=C(C)CCC=C(C)C)c(O)cc(O)c4C(OC(=O)C)C(CC=C(C)C)=C3O)CC2)C)ccccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 628.806
CB1 binding score: -16.778
InChIKey:BELQNZBXGDWTFW-UHFFFAOYSA-N
ID: 35508
SMILES:C1=C(C)CCC(C(C)C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 35509
SMILES:Oc1cc2c(c(C)c1)CC(CCCC(C)(C)OC)(C)C(O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.446
CB1 binding score: -16.055
InChIKey:XDVALAMZHKREGR-UHFFFAOYSA-N
ID: 35510
SMILES:c1(C(=O)COC(C(C)CC)=O)c(O)c2c(c(C=O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -15.22
InChIKey:XASQCPJKQCUGAH-UHFFFAOYSA-N
ID: 35511
SMILES:C(C)(C)C1(C)CCC(C)=CC1c1cc(CCCCC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.513
CB1 binding score: -15.968
InChIKey:DWQWBJFFNOMSEB-UHFFFAOYSA-N