ID: 99016
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N
ID: 99017
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 99018
SMILES:C1CC(C)C2(C)C3(c4c(cc(CCCCC)cc4O)OC13)CO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.948
InChIKey:OMVNIMHXXQESTJ-UHFFFAOYSA-N
ID: 99019
SMILES:c12c(c(O)cc(CCCCC)c1)C1=C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 99020
SMILES:c1c(O)c2c(cc1CCCC)OC(C)(C)C1=C3C(=O)C(C)=C(O)C1(O)C(C)CCC3C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -16.412
InChIKey:ZMJRESHAWOPFJB-UHFFFAOYSA-N
ID: 99021
SMILES:Oc1cc(CCCCC)cc(O)c1C12OC3C(C(C)C1)OC(C=C(C)C)OC3=CC2OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.002
InChIKey:WGTZXIQRYUWLHG-UHFFFAOYSA-N
ID: 99022
SMILES:C(Cc1cc(O)c(C2C=C(C)C(Cl)CC2C(=C)C)c(O)c1OC)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.924
CB1 binding score: -13.976
InChIKey:YCJKVZGLXMEIFT-UHFFFAOYSA-N
ID: 99023
SMILES:C1C2C(COC)CCC2C(C)(C)Oc2cc(CC)c(OC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.29
InChIKey:NARZFLVJCAHKGB-UHFFFAOYSA-N
ID: 99024
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1=CC(=O)C(C)(CC3OC(=O)C(C)=C3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -15.053
InChIKey:BBJXAXOPSPNQMF-UHFFFAOYSA-N
ID: 99025
SMILES:C(C)CCCc1cc(O)c2c(c1)OC1(C)C2CC(C(CCC=C(C)CO)(O)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -16.317
InChIKey:YFGPAAGVUXQYIL-UHFFFAOYSA-N
ID: 99026
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C3C(CCC(=C)C3C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.605
InChIKey:IDMGOUATGFCGFG-UHFFFAOYSA-N
ID: 99027
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(O)(C)C)CCC(C)=C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.828
InChIKey:MHHSSHQFSKAMDO-UHFFFAOYSA-N
ID: 99028
SMILES:C(C=C(C)CC(O)C=C(C)C)c1c(O)c(C(O)=O)c(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.132
InChIKey:SBJHUAFEWVJEPI-UHFFFAOYSA-N
ID: 99029
SMILES:C12Oc3c(c(O)cc(C)c3)C3C1C(=CC(C)(C)O2)OC1(CC3)C=CC(=O)OC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -13.951
InChIKey:GUGZWPBXZMUSLL-UHFFFAOYSA-N
ID: 99030
SMILES:C(Cc1cc(O)cc(CC=C(C)CCC=C(C)C)c1O)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 99031
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 99032
SMILES:C1(C)(C)C23CCC1C(C)(C)OC2=C(C)C(=O)C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -15.119
InChIKey:RCEANQFCCGIMRH-UHFFFAOYSA-N
ID: 99033
SMILES:C1C(C(=C)C)C(c2cc(CCN(C)C)ccc2OC)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 99034
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 99035
SMILES:C12C(c3c(cc(C)cc3O)O1)CC(C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -18.853
InChIKey:JJACOURBOAWAMK-UHFFFAOYSA-N
ID: 99036
SMILES:O(c1c(CCCC)cc(O)c2c1OC1(C)CCC(C(C)C)=CC1C(O)C2)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.2
InChIKey:WPIMXRUNYJXHDF-UHFFFAOYSA-N