ID: 42736
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: 42737
SMILES:CC1(C)C=C(C)CC2(c3c(cc(CCCCC)cc3O)OC2)C=C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.804
InChIKey:DOFSRFVHUVUUKP-UHFFFAOYSA-N
ID: 42738
SMILES:CC(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 42739
SMILES:C=C(C1C(OC(C)=O)C(O)C(C)=CC1c1cc(OC)cc(C)c1O)CCC(OC(C)=O)C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.593
CB1 binding score: -15.763
InChIKey:LNVHORJJXYNCRO-UHFFFAOYSA-N
ID: 42740
SMILES:C(CCc1cc2c(c(O)c1)C1C(O)C(C)(CCC1C(C)=C)O2)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -14.342
InChIKey:GWGSGFOTXUZKPB-UHFFFAOYSA-N
ID: 42741
SMILES:O(c1ccc2c(c1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.071
InChIKey:QJRPBWFSXAYWJJ-UHFFFAOYSA-N
ID: 42742
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 42743
SMILES:CC1C2(Oc3c(c(O)cc(CCC(OC)=O)c3)C2)C(C)(C(O)CC(C)C)CC(=O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -17.147
InChIKey:HMCIOUTVKLRPKC-UHFFFAOYSA-N
ID: 42744
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 42745
SMILES:C(Cc1c(CCCC)cc2c(c1O)C1C(C1)C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -15.267
InChIKey:HPCZEBQNLUSMDU-UHFFFAOYSA-N
ID: 42746
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C2OC3C(C)(O3)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.633
InChIKey:UPGGJBSWBYAKAZ-UHFFFAOYSA-N
ID: 42747
SMILES:O=C(C1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 42748
SMILES:CC(=CCC1Oc2c(c(O)cc(CCCCC)c2)C(O)C1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.444
InChIKey:KHRFDJNHLGNVPY-UHFFFAOYSA-N
ID: 42749
SMILES:OC1C2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C2OC(CC(C)(O)C(O)CCC(C)=CC1O3)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.648
CB1 binding score: -16.009
InChIKey:LHLAAWDTHFAWBN-UHFFFAOYSA-N
ID: 42750
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(OC)ccc(CCN(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 42751
SMILES:O=Cc1c(CCCCC)cc2c(c1O)C1C(C(=C)C)CCOC1=CC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -13.945
InChIKey:SXIKTLOGPDSYLU-UHFFFAOYSA-N
ID: 42752
SMILES:CC(C)C1CCC(C)=CC=Cc2ccc(C(C)(CCCCCC)C)cc2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.633
CB1 binding score: -14.713
InChIKey:XDIUNSADRKEEFX-UHFFFAOYSA-N
ID: 42753
SMILES:COc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.823
InChIKey:GRLARWXSTOXAGR-UHFFFAOYSA-N
ID: 42754
SMILES:C1(CO)(C)C2CCC(C)=CCc3cc(C(O)=O)ccc3OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.861
InChIKey:JKOLVDWAKBEYFC-UHFFFAOYSA-N
ID: 42755
SMILES:c1(Cl)c(OC)cc(O)c(C2C(C(C)=C)CC(O)C(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.805
CB1 binding score: -15.742
InChIKey:RSODKXJQLNTHOX-UHFFFAOYSA-N
ID: 42756
SMILES:C(C)(C1C(c2c(O)cc(CCCCCO)cc2O)C=C(C)C(=O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.654
InChIKey:QCZJAZXCIATSSS-UHFFFAOYSA-N