ID: 52123
SMILES:C1(C)(C)C2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2O)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.96
InChIKey:DDIVQORSYYKRDX-UHFFFAOYSA-N
ID: 52124
SMILES:C(C(C)=CCc1c(O)c(C)cc(O)c1)CC=C(C)CC1OC(=O)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.334
InChIKey:UKIHTVVZTOBHII-UHFFFAOYSA-N
ID: 52125
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1(O)C(=O)C(C)(C)OC1(CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.609
InChIKey:WWNJDEBYYSLOOS-UHFFFAOYSA-N
ID: 52126
SMILES:CC(C)=CCCC(C)=Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.241
InChIKey:SZDCHLKRZNALJX-UHFFFAOYSA-N
ID: 52127
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(ccc(C(O)=O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -19.478
InChIKey:HNVKFYQXRFNXOU-UHFFFAOYSA-N
ID: 52128
SMILES:N(C1C(C)(C)Oc2cc(C)c(O)cc2C1(C)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 275.392
CB1 binding score: -12.836
InChIKey:BSLIYKXLDFKMDP-UHFFFAOYSA-N
ID: 52129
SMILES:C(=CC)C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -14.93
InChIKey:RJLHKRPRSGJQQJ-UHFFFAOYSA-N
ID: 52130
SMILES:C(CCC)Cc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 52131
SMILES:C(CCCC)c1cc2c(c(OC)c1)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.06
InChIKey:KSDSETBZUIJIFF-UHFFFAOYSA-N
ID: 52132
SMILES:C(CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1CC=C(C)C)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.502
InChIKey:QWGNSQSNGXMUGH-UHFFFAOYSA-N
ID: 52133
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(C)(OC(=O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.364
InChIKey:ZHNZZIQWUIWFEJ-UHFFFAOYSA-N
ID: 52134
SMILES:O1c2cc(CCCCC)c(C(=O)O)c(OC)c2C2C(CCC(C)=C2)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.571
InChIKey:DCYPRIDTLZQDTF-UHFFFAOYSA-N
ID: 52135
SMILES:C12c3c(cc(CCCC)cc3O)OC3(C)CC(C(O)C)C(CC1)C3C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.172
InChIKey:BCVJYUYZGSLCAQ-UHFFFAOYSA-N
ID: 52136
SMILES:C1c2c(OC)cc(CCCCC)cc2OC(C)(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -15.519
InChIKey:CFUFDNSFYBAESZ-UHFFFAOYSA-N
ID: 52137
SMILES:C12(C)CCC(OC(C)=O)C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C1C(=O)C(C)=CC2=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.596
CB1 binding score: -13.383
InChIKey:CSHPVJBXWYZZCS-UHFFFAOYSA-N
ID: 52138
SMILES:CC1C(CC(O)=O)c2c(cc(C(C)(C)C)cc2)-c2c(cc(CCCCC)cc2O)-1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -14.902
InChIKey:VDNUOAHSUAVLNU-UHFFFAOYSA-N
ID: 52139
SMILES:c1cc(-c2cc(OC)c3c(c2)OC(C)(C)C(CCC(OC(=O)C)(C)CCC=C(C)C)C3O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -13.625
InChIKey:KTUMRXOVPRDGLM-UHFFFAOYSA-N
ID: 52140
SMILES:CC(C)=CCCC(CO)=CCc1cc(O)cc(C)c1OC1(C)C=CC(=O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -12.65
InChIKey:IRVUPFHISIXPIZ-UHFFFAOYSA-N
ID: 52141
SMILES:c1(O)cc(C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 52142
SMILES:C(C1C(C(C)=C)CCC=C1)CC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.848
InChIKey:FZYNBURSHRVXPF-UHFFFAOYSA-N
ID: 52143
SMILES:c1c(OC)c(C)c2ccc3c(c2c1)C1C(C(C)(C)O3)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.448
CB1 binding score: -14.25
InChIKey:DWERZGCBAATGNO-UHFFFAOYSA-N