ID: 38851
SMILES:C1Cc2c(cc(CCCCC)cc2O)C(C)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.394
CB1 binding score: -16.489
InChIKey:IXWMVQJVQBZHMA-UHFFFAOYSA-N
ID: 38852
SMILES:C(CCCCc1cc2c(c(O)c1C(=O)CC(C)C)OC(C)(C)C1CC(=O)C(C)=CC21)C(O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.731
CB1 binding score: -16.425
InChIKey:BAHPUCNLDGHOKY-UHFFFAOYSA-N
ID: 38853
SMILES:C=C(C)CCc1c(C)c(O)c(-c2c3c(cc(CO)c2O)OC(C)(C)C2CCC(C)=CC23)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -15.231
InChIKey:BPCBZSMDJCNRJD-UHFFFAOYSA-N
ID: 38854
SMILES:C(CCC)Cc1cc2c(c(OC)c1)C1C(CC=C(C)C1)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -14.244
InChIKey:KSGZDQRWHFHIRS-UHFFFAOYSA-N
ID: 38855
SMILES:C(CC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 38856
SMILES:c1(C=O)cc(O)c2c(c1CC(O)C(=O)C)OC(C)(C)C1C2C(CCC(C)C)C(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -11.791
InChIKey:OKRUPPKMDNHNSV-UHFFFAOYSA-N
ID: 38857
SMILES:c12ccc(OC(C)=O)cc1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -14.983
InChIKey:IXPQEIADSLCAQW-UHFFFAOYSA-N
ID: 38858
SMILES:C(CC(C(C)(C)C)=O)C1(C)Oc2c(c(O)cc(CCCCC)c2)-c2cc(O)ccc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.78
InChIKey:KGLIFHZJKTZKDS-UHFFFAOYSA-N
ID: 38859
SMILES:C(CC)CCc1cc2c3c(c1)OCC1C(=CCCC(C)=CCC1C(C)=C)C(=O)C32C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.594
CB1 binding score: -14.528
InChIKey:XWUVCOVSSSPNBY-UHFFFAOYSA-N
ID: 38860
SMILES:CC1(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 38861
SMILES:C(c1c(O)cc2c(c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.925
InChIKey:ZGKXGXKDEVYSLO-UHFFFAOYSA-N
ID: 38862
SMILES:c1(CCC)cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.975
InChIKey:QENGDQLFFGIXRS-UHFFFAOYSA-N
ID: 38863
SMILES:c1(C(=O)C(CC)C)c(O)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 38864
SMILES:C(C)(=C1CCC2(C)Oc3c(c(O)cc(CCCC)c3)C(O)C2C1C(OC)=O)CC#C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -14.949
InChIKey:SDEUZQSDTKPBJK-UHFFFAOYSA-N
ID: 38865
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -18.766
InChIKey:OKXUDFJPZMVBEH-UHFFFAOYSA-N
ID: 38866
SMILES:C12c3c(O)cc(C)cc3OC(C)(C)C3CCC(C)C(CC(C)(O)C1)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.155
InChIKey:OTSNAKNCYJCUNT-UHFFFAOYSA-N
ID: 38867
SMILES:c1c(O)cc2c(c1OC)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.662
InChIKey:MTJFYDONBDGRHM-UHFFFAOYSA-N
ID: 38868
SMILES:C(C)CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 38869
SMILES:C(CCCC)Cc1cc2c(c(O)c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.314
InChIKey:WXNUPUXYMUFWOY-UHFFFAOYSA-N
ID: 38870
SMILES:c12c(c(O)cc(CCCCC)c1)C(=O)c1cc(C)ccc1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -16.615
InChIKey:GNYDDYAATAGGQG-UHFFFAOYSA-N
ID: 38871
SMILES:CC12CC3c4c(cc(CCCCC)cc4OC1O)OC2(C)CC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.053
InChIKey:CGPPYXYKPMQCLA-UHFFFAOYSA-N