ID: 58717
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 58718
SMILES:C1(C)(O)CC(OC(C(C)=CC)=O)C2c3c(O)cc(CCCC)cc3OC2(C)C1C(C(C)C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -13.583
InChIKey:NRTRKGVKUQYICF-UHFFFAOYSA-N
ID: 58719
SMILES:C(C)(CC(C)=CCC1(C)Oc2c(C)cc(O)c(C(C(C)=C)CCCCC)c2C2C=C(CO)CCC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.716
CB1 binding score: -14.035
InChIKey:PQSJOCJARQYFNF-UHFFFAOYSA-N
ID: 58720
SMILES:C(C(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)CC1O)O)CC(C(C)(O)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.589
CB1 binding score: -14.901
InChIKey:QHWHUEWWMWTZBH-UHFFFAOYSA-N
ID: 58721
SMILES:C(C)(=CCc1ccccc1OC1(c2c(O)cc(O)cc2C)OC(C)(CCC=C(CCC=C(C)C)C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.738
CB1 binding score: -15.12
InChIKey:PHUOINIDVDLESH-UHFFFAOYSA-N
ID: 58722
SMILES:c1(C)c2c(ccc1C)C(CO)(C)Oc1c2c(O)cc(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.355
CB1 binding score: -16.348
InChIKey:QXFBDJXJTQKIMK-UHFFFAOYSA-N
ID: 58723
SMILES:C=C(C1C(c2c(O)cccc2)C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 58724
SMILES:C1CC(C)C2=C(CC1(C)COC(=O)C)C(C)(C)Oc1cc(C)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.277
InChIKey:ITSPGOPBKLWSOC-UHFFFAOYSA-N
ID: 58725
SMILES:Oc1c(C(OC)=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -16.109
InChIKey:HCVQNFRSSBTPDB-UHFFFAOYSA-N
ID: 58726
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(O)(C)CCC(C(C)=C)O)CC1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.974
InChIKey:JYSPMAOQTLOWTG-UHFFFAOYSA-N
ID: 58727
SMILES:c1(O)c2c(cc3c1cc(C(C)(C)C)cc3)OC1C(O)(C(C)(C)O2)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -15.068
InChIKey:SCJJICOVBSGFLF-UHFFFAOYSA-N
ID: 58728
SMILES:C1C(=C)C2C(O)(c3c(cc(CCCCC)cc3O)O1)C(=C(C)C)CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.324
InChIKey:JYVAOMPOBBGKGZ-UHFFFAOYSA-N
ID: 58729
SMILES:C(=Cc1c(O)c2c(cc1OC)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.605
InChIKey:OGOMPUPORZEXJG-UHFFFAOYSA-N
ID: 58730
SMILES:CC(=CCC(C(C)=C)Cc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -17.001
InChIKey:RKUWYTJVXYVLJY-UHFFFAOYSA-N
ID: 58731
SMILES:C1(=O)C2=C(C=CC1C)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.557
InChIKey:DIIWBHAKJHXXOX-UHFFFAOYSA-N
ID: 58732
SMILES:C1C(O)C(C)(C)Oc2c(CC=C(C)C)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -11.484
InChIKey:PGZWHEIJYYEWGB-UHFFFAOYSA-N
ID: 58733
SMILES:c1ccc(C2C=C(C)CCC2C(=C)C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N
ID: 58734
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C=CC(=C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.831
InChIKey:PRBYMEIBAFVCKU-UHFFFAOYSA-N
ID: 58735
SMILES:CC(=O)Oc1c(CC=C(C)CCC=C(C)C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -16.502
InChIKey:NXQDRPGFIKCTMA-UHFFFAOYSA-N
ID: 58736
SMILES:CC(=CCCC(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -19.572
InChIKey:KKASRYPDNSSAPZ-UHFFFAOYSA-N
ID: 58737
SMILES:C(c1cc2c(cc1)OC(C)(C)C1C2CC(C)(O)C(O)C1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -12.783
InChIKey:JYOHFMNAPCSQOJ-UHFFFAOYSA-N