ID: 92023
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 92024
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1cc(O)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.519
InChIKey:VUNPRPMLATVOJE-UHFFFAOYSA-N
ID: 92025
SMILES:Ic1c(CC=C(C)CCC=C(C)CCC=C(C)C)cc(O)cc1CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.474
CB1 binding score: -16.687
InChIKey:PMJGMUKLAWLMMV-UHFFFAOYSA-N
ID: 92026
SMILES:C(C(O)=O)(C)C(Cc1c2c(ccc1O)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.764
InChIKey:VPIVUIQMXJVSCF-UHFFFAOYSA-N
ID: 92027
SMILES:c12c(c(O)c(C(=O)O)c(CCCCC)c1)OC1(C)CCC3C4C1C3C(C)(C)OC4(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -13.999
InChIKey:FYYSNIBQBLEJJO-UHFFFAOYSA-N
ID: 92028
SMILES:C1CC2(O)C(c3c(OC)cc(C(C)C(C(C)CC)=O)cc3OC2(C)C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.22
InChIKey:QXAYAYQGYYKLIJ-UHFFFAOYSA-N
ID: 92029
SMILES:C(CCC1(C)C2CC3C(C31C)c1c(O)cc(CCCCC)cc12)=C(C(O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -16.19
InChIKey:UTHJTMBNLSKGQZ-UHFFFAOYSA-N
ID: 92030
SMILES:c1(CCCCC)cc(O)c2c(c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N
ID: 92031
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC1(C)C(C(=O)CC(C)=C1)C1(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: Not available
InChIKey:DKYNWZDJAWTAAW-UHFFFAOYSA-N
ID: 92032
SMILES:Oc1c(CC=C(C)C)c(O)c(C=O)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.049
InChIKey:UTQODHOHWHAWHC-UHFFFAOYSA-N
ID: 92033
SMILES:c1(CCC)c(C(O)=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -15.805
InChIKey:KJCCRFBBAWHUAT-UHFFFAOYSA-N
ID: 92034
SMILES:C1(c2c(O)cc(C(C)CCCC)cc2O)C(C(C)=C)CCC1(C)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -16.431
InChIKey:VMRRCCXSIHQCHC-UHFFFAOYSA-N
ID: 92035
SMILES:C(CCc1cc2c(cc1O)CC(O)C(C)(C)O2)C1(C)CCCc2c3c(cc(C)c2C1O)OC(C)(C)C=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -15.374
InChIKey:CCCWCSGOAYPPDW-UHFFFAOYSA-N
ID: 92036
SMILES:C1(COC(=O)c2ccccc2)(C)C2(O)Oc3c(c(OC)cc(CCCCC)c3)C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.584
CB1 binding score: -13.98
InChIKey:HOUUSRCKLUTZBG-UHFFFAOYSA-N
ID: 92037
SMILES:COc1c(C)cc(OC)c2c1C1C(C(C)(C)O2)CCC(=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.114
InChIKey:ACCFSKYFJYDBCC-UHFFFAOYSA-N
ID: 92038
SMILES:CC1(C2C(c3c(O)cc(CCCCC)cc3O)OC2C=C(C)C)CCCC(C)(C)C1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.819
InChIKey:GENJZEKKOMLYBY-UHFFFAOYSA-N
ID: 92039
SMILES:CC(C)=CCc1cc2c(cc1C)OC(C)(C)C1C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.389
InChIKey:ZEDYUEBCGFAKSX-UHFFFAOYSA-N
ID: 92040
SMILES:c1(CCCCCC)cc2c(c(OC)c1)CC1C(CCC=C(CCC=C(C)C)C)(C2)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -9.836
InChIKey:SWWDBSFMEOZCIE-UHFFFAOYSA-N
ID: 92041
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 92042
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=C3C4C(C(C)C)CCC13CC2OC4=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.191
InChIKey:FIDUXBMDOIESSE-UHFFFAOYSA-N
ID: 92043
SMILES:C1C(=O)C2(OC2=C(C)C)Oc2cc(CCCCC)cc(OC)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -12.731
InChIKey:FIAVOBHQOMNKSL-UHFFFAOYSA-N