ID: 86143
SMILES:CC1(C)Oc2cc(C)cc(O)c2C2C1C=CC(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.269
InChIKey:UJUOIUNDVOQUOS-UHFFFAOYSA-N
ID: 86144
SMILES:C1(=C)C2C(c3c(O)cc(CCCCC)cc3O1)C(=O)C(C)CC2C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -15.725
InChIKey:RDKVUXDMUUCBHU-UHFFFAOYSA-N
ID: 86145
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C3CC(C)(C)CC(O1)C3(C#N)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 383.488
CB1 binding score: -13.824
InChIKey:GXDKEXJDJVFLSU-UHFFFAOYSA-N
ID: 86146
SMILES:c1cc(C(=O)CCc2cc3c(c(O)c2)C2C(C(C)(C)O3)CC2)cc(CC=C(C)C)c1O
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Chalcones
MW: 420.549
CB1 binding score: -12.744
InChIKey:RIBSIHMIZVZGQD-UHFFFAOYSA-N
ID: 86147
SMILES:O(c1c2c(cc(C=O)c1)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.265
InChIKey:YTXHODXEFGYFNL-UHFFFAOYSA-N
ID: 86148
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CO)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.967
InChIKey:XTDYIISRNODHHT-UHFFFAOYSA-N
ID: 86149
SMILES:O1C(C)C2C(c3c(O)cc(CCCCC)cc3O2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -13.354
InChIKey:PYCPQQAGPRFCOD-UHFFFAOYSA-N
ID: 86150
SMILES:c1(O)c(C)cc(OC)cc1CC=C(C)CCC=C(C)CC1OC(=O)C(CC)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.735
InChIKey:ZUBKMNCYUSMGID-UHFFFAOYSA-N
ID: 86151
SMILES:CC1(C)C=CCC2(C)Oc3c(c(OC)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.297
InChIKey:ZTOOFUDKGMEIFS-UHFFFAOYSA-N
ID: 86152
SMILES:c1(C)cc2c(c(O)c1OC)C1C(CCC(C)C1(C)CCC(=CCO)C=O)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.669
InChIKey:RYTXHGFTAWXVEG-UHFFFAOYSA-N
ID: 86153
SMILES:C(C1=C(C)C2CC2(C(OC)=O)c2c(O)cc(CCCCC)cc21)(C=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: Not available
InChIKey:SGMIYXRBQGFILN-UHFFFAOYSA-N
ID: 86154
SMILES:Oc1c(CC=C(CCC=C(CO)C)C)c(O)cc(CCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.444
InChIKey:LMXDVMKNVXGKAL-UHFFFAOYSA-N
ID: 86155
SMILES:C(C1CC(C=C(C)C)c2c(O)cc(CCCCC)cc2O1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.812
InChIKey:PJJHMAREXVZLDV-UHFFFAOYSA-N
ID: 86156
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 86157
SMILES:C(CCCC)c1cc(O)c2c(c1)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: 86158
SMILES:c1(OC)cc2c(cc1C(=O)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.162
InChIKey:BXSUDHAXDSJMSK-UHFFFAOYSA-N
ID: 86159
SMILES:C(Cc1c(C(O)=O)cc(CC=C(CCC=C(C)C)C)c(O)c1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.442
InChIKey:AAFJPXGUYZGKEL-UHFFFAOYSA-N
ID: 86160
SMILES:O=C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C(=C(C)C(=O)C1)C2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.519
InChIKey:QXMMZYVOHURDEK-UHFFFAOYSA-N
ID: 86161
SMILES:C1(C)CC2(O)c3c(cc(CCCCC)c(O)c3OC1(C)C)C(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.502
InChIKey:SBRVYGZBRJEYPX-UHFFFAOYSA-N
ID: 86162
SMILES:C1c2c(O)c3c(cc2C)OC(C)(C)C2CCC(C)C1CC23
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -13.991
InChIKey:PIMUJMQNIRGAHD-UHFFFAOYSA-N
ID: 86163
SMILES:C(CCC)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N