ID: 110209
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(O)(C)CCC1C(C)=C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.142
InChIKey:RBEAVAMWZAJWOI-UHFFFAOYSA-N
ID: 110210
SMILES:OC(C)(CCc1cc2c(c(OC)c1)OC(CCC(=O)OCCC1C(=O)c3cc(C)c(C)o3)(C)C1C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -13.941
InChIKey:XQLARDIURDRBQS-UHFFFAOYSA-N
ID: 110211
SMILES:C1(=C)C2(c3c(O)cc(CCCCC)cc3OC2(C)C)CCC1(C)OO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.944
InChIKey:XQAWBJFXJOGDNQ-UHFFFAOYSA-N
ID: 110212
SMILES:CC(C#Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(COC(=O)CCC(NCCS(O)(=O)=O)=O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 603.778
CB1 binding score: -14.008
InChIKey:JHUNDYSDEPHPTE-UHFFFAOYSA-N
ID: 110213
SMILES:C(c1c(O)cc(CO)c(C2C(C(C)C(O)CC=C(C)C)CCC(C)=C2)c1O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -15.331
InChIKey:MBFPQRDCKZCSBX-UHFFFAOYSA-N
ID: 110214
SMILES:c1c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 110215
SMILES:c1(CC=C(CCC=C(C)C)C)cc(O)c(CC=C(C)C)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.159
InChIKey:SNSOBJQITAPANC-UHFFFAOYSA-N
ID: 110216
SMILES:CC1(C)C2C(CC(C)=CC2)c2c(cc(CCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 110217
SMILES:c1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 110218
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 110219
SMILES:C1CC(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2O)(CC=C(C)C)C(=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 416.558
CB1 binding score: -16.438
InChIKey:AJJOIUORYCMQJI-UHFFFAOYSA-N
ID: 110220
SMILES:CC12c3c(cc(CCCCC)cc3O)OC1CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.522
InChIKey:QZKWYQFVUHJUSX-UHFFFAOYSA-N
ID: 110221
SMILES:O(C(C1C2C(CC(C)=CC2)c2c1c(O)cc(CCCCC)c2)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.136
InChIKey:XTLYLRNNEVPDCK-UHFFFAOYSA-N
ID: 110222
SMILES:CC1=CC=C(C(=C)C)CCC(c2c(O)c3c4c(c2O)-c2c(O)cc(CCCCC)cc2OC(C)(C)C4CC3)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 542.76
CB1 binding score: -15.302
InChIKey:JUUSCAQCQPREBI-UHFFFAOYSA-N
ID: 110223
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12O)CCC=CC(=O)OCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -13.646
InChIKey:PQKRASGXONPAFL-UHFFFAOYSA-N
ID: 110224
SMILES:C(C)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 110225
SMILES:C(c1cc(OC)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2)CCCCC#CC=CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.651
CB1 binding score: -15.097
InChIKey:KACWULNUMUKUJB-UHFFFAOYSA-N
ID: 110226
SMILES:c1cc(CCCC)cc2c1C1C(C(C)(C)O2)CC=C(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.089
InChIKey:YGGSWRXLJSNPHI-UHFFFAOYSA-N
ID: 110227
SMILES:c1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.334
InChIKey:GKTLMTLABYYGES-UHFFFAOYSA-N
ID: 110228
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CC(OC(CCCCCCCCCCCCCCC)=O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 568.883
CB1 binding score: -16.824
InChIKey:FAVARMUKFBFOLF-UHFFFAOYSA-N
ID: 110229
SMILES:CC1(C)Oc2c(cc(Br)c(C)c2)C1(C)CCC(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 327.262
CB1 binding score: -13.533
InChIKey:WYQZISPXGVZQHV-UHFFFAOYSA-N