ID: 110839
SMILES:C1C2C(c3c(O)cc(CCCCC)cc3O1)CCC(C)C2(CCC1=CC(=O)OC1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.924
InChIKey:XMOSKZZYTMBUOQ-UHFFFAOYSA-N
ID: 110840
SMILES:c1c(O)ccc2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -17.529
InChIKey:WQXFMLNUWABCFK-UHFFFAOYSA-N
ID: 110841
SMILES:c1(-c2cc(CCCC)ccc2)c(O)c(C2C=C(C)CCC2C(C)C)c(O)cc1CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.691
CB1 binding score: -15.706
InChIKey:AHLSOACCHWMIBI-UHFFFAOYSA-N
ID: 110842
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C(C=C(C)C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.165
InChIKey:RYGKXMGSTFRRHV-UHFFFAOYSA-N
ID: 110843
SMILES:C(C)(C1CCC(C)=CC1c1c(O)cc(CCCCCOC(CC(CC)C)=O)cc1O)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -13.522
InChIKey:KLCCMOGJLLCKOL-UHFFFAOYSA-N
ID: 110844
SMILES:C(=C)(CCCC(CCCC1(C)Oc2c(c(O)cc(C)c2-c2ccccc2)CC1OC(C)=O)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -14.191
InChIKey:KQNIFYJVZOWPNY-UHFFFAOYSA-N
ID: 110845
SMILES:C1(CCCC(=CCc2c(O)c(C)cc(O)c2)C)COC(C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.871
InChIKey:LCKDQSWHRAIDLV-UHFFFAOYSA-N
ID: 110846
SMILES:CC(C)=CCc1c(O)c(-c2c(O)c3c(c4c2OC2(C)CCC3C(C)(C)C2C4)c(C)cc1O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.711
CB1 binding score: -15.116
InChIKey:MDARZPSHLFFBLC-UHFFFAOYSA-N
ID: 110847
SMILES:C(Cc1cc(C2C(C(=C)C)CCC(C)=C2)c(O)cc1)CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.551
CB1 binding score: -15.283
InChIKey:FBPTVTLLVBCMTK-UHFFFAOYSA-N
ID: 110848
SMILES:c1(O)cc(CCCCC)cc2c1C1CC(C)=CCCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.792
InChIKey:WHYWQKKPJPKIAC-UHFFFAOYSA-N
ID: 110849
SMILES:c1c(CCCCC)cc2c(c1)OC(C)(C)c1c-2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -12.497
InChIKey:QMUWKXIPEQILJV-UHFFFAOYSA-N
ID: 110850
SMILES:C1(C)(C)C2C3(C(C)CC2)Cc2c(O)cc(CCCCC)cc2OC13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: Not available
InChIKey:LLASVAWSZGUFRU-UHFFFAOYSA-N
ID: 110851
SMILES:C1(C)=CCC(C(C)C)C2c3c(c(OC)cc(CCCC)c3)C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 340.551
CB1 binding score: -14.429
InChIKey:BIHJHRZBIXAIKJ-UHFFFAOYSA-N
ID: 110852
SMILES:C(Cc1cc2c(c(O)c1)C1CC(O)(CC=CC1(C)C)O2)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.787
InChIKey:VAFQYBIBXVOMOX-UHFFFAOYSA-N
ID: 110853
SMILES:C1(C)(C)C2C(C=C(C)CC2)Cc2c(O)cc(C(C)C(=O)C(C)CC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -14.462
InChIKey:WZXGMFHXLQNBPB-UHFFFAOYSA-N
ID: 110854
SMILES:c1(C)cc(OC)c(C2C=C(C)CCC2C(=C)C)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.742
InChIKey:ASHSLJCTDSOLLS-UHFFFAOYSA-N
ID: 110855
SMILES:C(C1CCC(C)=CC1c1c(O)ccc(O)c1)(=CC=CC(C)(O)CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.725
InChIKey:YXQFKQJVKPMKIC-UHFFFAOYSA-N
ID: 110856
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 110857
SMILES:C12Oc3cc(O)c(CC=C(C)CCC=C(C)C)c(O)c3C1C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -12.108
InChIKey:HPGQNBDOJDVISX-UHFFFAOYSA-N
ID: 110858
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)c(C(=O)OC)c(O)c(CC(CCCCCCCCC)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -14.026
InChIKey:NRKMDIYFLAFNIF-UHFFFAOYSA-N
ID: 110859
SMILES:C(Cc1c(O)c(C2C=C(C)CCC2C(C)=C)c(OC2OC(C)C(O)C(O)C2O)c(OC(C)=O)c1O)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 614.776
CB1 binding score: -15.916
InChIKey:WTKJXPXTXQERSY-UHFFFAOYSA-N