ID: 96013
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 96014
SMILES:C1(C)CCC(C(C=O)=C)C(c2c(O)cc(CCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.827
InChIKey:FWDJCYRNMWKFIR-UHFFFAOYSA-N
ID: 96015
SMILES:C(=CCCC(C)=CCCC1(C)Oc2cc(C)c(O)cc2C=C1)=CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -15.945
InChIKey:TVGGFXFPRZEKTP-UHFFFAOYSA-N
ID: 96016
SMILES:c1(C(CCCC)OC(C)=O)c(O)c2c3c(cc(C)c2)OC(C)(C)C3C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -15.108
InChIKey:UJHUXENHEUVWCV-UHFFFAOYSA-N
ID: 96017
SMILES:CC(C(=O)C(C)c1c(O)c2c(c(C=O)c1O)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.178
InChIKey:VLZYEPQGSBBAJE-UHFFFAOYSA-N
ID: 96018
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)C2C1CCC(C(=O)O)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.51
InChIKey:LVQZQKXEEYFSQO-UHFFFAOYSA-N
ID: 96019
SMILES:C1C2(OC)C(C)=CC1c1ccccc1OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -13.068
InChIKey:XXYUCOBXFVDFPI-UHFFFAOYSA-N
ID: 96020
SMILES:C1c2c(OC)cc(CCCCC)cc2OC(C)(CCC=C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.454
InChIKey:VZFRXICVQKCJBK-UHFFFAOYSA-N
ID: 96021
SMILES:C12(C)CCC(OC(C)=O)C(C)(C)C1C(O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -11.791
InChIKey:KSHXKEYBSINSOK-UHFFFAOYSA-N
ID: 96022
SMILES:COc1ccc2cc(CC3CC(C)(C)CCC3)c(CC3(C)Oc4cc(C)cc(O)c4C(C(=C)C)C3)c(NC(C(C)C)=O)c(OC)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 627.866
CB1 binding score: -15.293
InChIKey:TUQJZFITZOJMKN-UHFFFAOYSA-N
ID: 96023
SMILES:CCC(C(=O)c1cc(O)c(C2C=C(C(O)=O)CCC2C(O)(CCCC(C)C)C)c(O)c1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -13.465
InChIKey:MVQVEBVLNJSURW-UHFFFAOYSA-N
ID: 96024
SMILES:C(CCC(C)=CCOc1cc2c(c(OC(C)=O)c1)OC(C)(C)C1C2C=C(COC(=O)CC)CC1)(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 496.644
CB1 binding score: -13.839
InChIKey:INPQEJJKCWTEAO-UHFFFAOYSA-N
ID: 96025
SMILES:O(c1c2c(cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(=C)C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.687
InChIKey:PNYJFGSNEQYLHC-UHFFFAOYSA-N
ID: 96026
SMILES:c12c(cc(C(C)(C)CCCCCC)cc1)OC(C(=C)CCC=C(CCC=C(C)C)C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.724
CB1 binding score: -12.7
InChIKey:WTGDYUFXVGLXHI-UHFFFAOYSA-N
ID: 96027
SMILES:OC(CC)Cc1cc(OC)c(O)c(C2C=C(C)CCC2C(C)=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.101
InChIKey:SNKIRYZLZXZXNB-UHFFFAOYSA-N
ID: 96028
SMILES:Oc1c(C(=O)CC(CCC)C)c(O)c2c(c1O)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -15.304
InChIKey:IGSPUAIDIDCZCD-UHFFFAOYSA-N
ID: 96029
SMILES:O(CC)c1c(C)c(O)c(C)c2c1OC(C)(C)C1CC=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.929
InChIKey:WDWPJIORVDJEQR-UHFFFAOYSA-N
ID: 96030
SMILES:c1(CCCCC)cc(O)c2c3c1C(=O)OC(C(C)(O)C)OC3C1C(CCC1C)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.867
InChIKey:WCKSSNPESKXWHM-UHFFFAOYSA-N
ID: 96031
SMILES:Cc1c(CCCC)cc2c(c1O)CC(C(=C)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.405
CB1 binding score: -15.274
InChIKey:RHMCOVKJBNLLQZ-UHFFFAOYSA-N
ID: 96032
SMILES:C(C)(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 96033
SMILES:OC1C(O)C(OCC(CCC=C(C)C)=C)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.885
InChIKey:BRTIELLWERULGC-UHFFFAOYSA-N