ID: 100759
SMILES:C(O)(CC1CC(CCCC)C2(C)C1(C)C(C(=CC)C)Cc1ccccc1O2)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.288
InChIKey:FUNXXOVPOXZHLH-UHFFFAOYSA-N
ID: 100760
SMILES:C1C2(O)C(C(C)(C)Oc3cc(C)c(O)cc32)CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 274.36
CB1 binding score: -17.255
InChIKey:FVTJOEZWPOIOLO-UHFFFAOYSA-N
ID: 100761
SMILES:C1C(C(=C)C(=O)O)CCC(O)(C)C2Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -13.962
InChIKey:XZQSVIVFNYAYQA-UHFFFAOYSA-N
ID: 100762
SMILES:c1(C2C(C(C)=C)CCC(C)=C2)c(O)cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -19.801
InChIKey:MISWBPJELUDMFI-UHFFFAOYSA-N
ID: 100763
SMILES:O1c2cc(CCCCC)cc(O)c2C2C=C(CO)C1C(=O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.342
CB1 binding score: -17.246
InChIKey:NIQSLMHHCIGAPH-UHFFFAOYSA-N
ID: 100764
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC2(C)O1)C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -14.674
InChIKey:BGVNPQFXFRKBRY-UHFFFAOYSA-N
ID: 100765
SMILES:Oc1c(C(C(CC)C)=O)c(O)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.998
InChIKey:URRHSZIHKQAPKK-UHFFFAOYSA-N
ID: 100766
SMILES:C(O)(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC12)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -15.526
InChIKey:CBECFLFPCZSUFR-UHFFFAOYSA-N
ID: 100767
SMILES:O1C(C)(C)C(N)Cc2c(O)c(O)c(CCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 265.353
CB1 binding score: -16.173
InChIKey:CIRMJSACQJNNNV-UHFFFAOYSA-N
ID: 100768
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 100769
SMILES:C1(C)(C(Cc2c[nH]c3c2cccc3)=C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 443.631
CB1 binding score: -15.287
InChIKey:WIUSNYXTHAXRCN-UHFFFAOYSA-N
ID: 100770
SMILES:c1c(OC)ccc(C2c3c(cc(CCCCC)cc3O)OC2CC=C(C)C)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -18.124
InChIKey:BPKYVDWOIHWQKO-UHFFFAOYSA-N
ID: 100771
SMILES:C12CCC(C)C1c1c(c(OC)c(C)cc1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -13.727
InChIKey:OCLSANHDHYCRQN-UHFFFAOYSA-N
ID: 100772
SMILES:O=C(OC1c2c(OC(C)=O)cc(CCCCC)cc2OC1(C)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -12.834
InChIKey:WARSAEKCFYCZMO-UHFFFAOYSA-N
ID: 100773
SMILES:Oc1c(CCOC)cc(O)c2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.306
InChIKey:RBAUBLZUAQSLSQ-UHFFFAOYSA-N
ID: 100774
SMILES:CC(C)C1C(OCC2=CCc3c(c(O)c(CC=C)cc3O)OC2)CC(C)=CC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.774
CB1 binding score: -12.769
InChIKey:MNSJTTJCHOPELF-UHFFFAOYSA-N
ID: 100775
SMILES:C12(C)CCC(C)C(=C)C1Cc1cc(C(O)=O)c(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.239
InChIKey:RRBGJCSQIDNNDT-UHFFFAOYSA-N
ID: 100776
SMILES:C12C(C)(CCC1C(C)=C)c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.987
InChIKey:GPNMBVOEJRJBDZ-UHFFFAOYSA-N
ID: 100777
SMILES:CC1(C)C2C(C(C)CC2)c2c(O)cc(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.57
InChIKey:JWVNDMUNWMFDDK-UHFFFAOYSA-N
ID: 100778
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 100779
SMILES:C(C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.438
InChIKey:HWNHLYTYNPXPGF-UHFFFAOYSA-N