ID: 105148
SMILES:C1C2C(O)C3(C)C(COC(C)=O)(Oc4cc(CCCCC)cc(O)c4C2C1C(C)C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -16.829
InChIKey:LZSBBAJPHJOSRC-UHFFFAOYSA-N
ID: 105149
SMILES:C(c1c(C)cc2c(c1)OC(C)(C)C=C2)CCC(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -15.932
InChIKey:MAVLAXIOFOPULE-UHFFFAOYSA-N
ID: 105150
SMILES:O=c1cc(O)c2c(cc1OC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.605
InChIKey:IZMSMCZATKFUOB-UHFFFAOYSA-N
ID: 105151
SMILES:CCC(C)(c1c(O)cc(C)c(O)c1O)CC(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.473
CB1 binding score: -14.173
InChIKey:YPWMDFAXTRGIIB-UHFFFAOYSA-N
ID: 105152
SMILES:Oc1cc(OC)c(O)c2c1-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -15.761
InChIKey:UQQVSMVTKKGBIH-UHFFFAOYSA-N
ID: 105153
SMILES:CC(C1C2Oc3cc(C)cc(O)c3C2C=C(C)C1)=CCCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.61
CB1 binding score: -14.317
InChIKey:PEWVFKZEKOMLDN-UHFFFAOYSA-N
ID: 105154
SMILES:CC(C)(O)C1(O)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -14.927
InChIKey:VRCLQJCMTUZZMQ-UHFFFAOYSA-N
ID: 105155
SMILES:C(CCCc1cc2c(c(O)c1)C1=C(C(C)(C)O2)CCC(C)(CCC=C(C)C)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -19.521
InChIKey:YYUDTSPOMLNTAE-UHFFFAOYSA-N
ID: 105156
SMILES:C(Cc1cc2c(cc1)C1C(C(C)(C)O2)C23C(C(C)(CC1=O)CO2)C(C)CC3OC(=O)C)CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.5
InChIKey:VRBBKCYCHLTMEJ-UHFFFAOYSA-N
ID: 105157
SMILES:c12c(cc(CCCCC)cc1O)OC1(C(C)CCC(C(=CC=CC(C)(O)C)C)C1OC(=O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -15.46
InChIKey:YFWPPGOMUHWUOZ-UHFFFAOYSA-N
ID: 105158
SMILES:C(=C(C)C)CCC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 105159
SMILES:C(C1=CCC(C)CC1c1c(O)cc(CCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -14.812
InChIKey:JWRGBTQYPGTVPQ-UHFFFAOYSA-N
ID: 105160
SMILES:c1c(OCC)c(C=O)cc(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.654
InChIKey:LCDUHWPCLANIJD-UHFFFAOYSA-N
ID: 105161
SMILES:c1(O)c2c(cc(CCCCCC)c1)OC(C)(C)C1=C2C(=O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -18.532
InChIKey:HCYCPDLZXAZZHU-UHFFFAOYSA-N
ID: 105162
SMILES:Oc1cc(O)cc2c1C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.332
CB1 binding score: -18.231
InChIKey:DWEAALYRKJACOY-UHFFFAOYSA-N
ID: 105163
SMILES:O1c2c(c(O)cc(CCCCC)c2)CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -18.796
InChIKey:BFFUWWHIAIGFJU-UHFFFAOYSA-N
ID: 105164
SMILES:C(C(C)=CCc1c(O)cc(CCC(=O)O)cc1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.143
InChIKey:QEKVOXFOINRURS-UHFFFAOYSA-N
ID: 105165
SMILES:CCCC(c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)Br
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.338
CB1 binding score: -16.537
InChIKey:VOHIQONDMSNQGD-UHFFFAOYSA-N
ID: 105166
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 105167
SMILES:CC1=CC(=O)CC1Cc1c(O)c2c(cc1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -14.71
InChIKey:IHLOWVOMPJQVAS-UHFFFAOYSA-N
ID: 105168
SMILES:C1(=O)CC(C)C2(C(C(=C)C)CCC2(CO)O)C1C(=O)c1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -14.534
InChIKey:DYIRAFRMMYFJDS-UHFFFAOYSA-N