ID: 97147
SMILES:C(CCCCCc1cc2c(c(O)c1)C1C3(CCC(C(C)(C)O)O1)OC(C)(C)C3C2)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -16.015
InChIKey:ZPUPLEYUXCEOMU-UHFFFAOYSA-N
ID: 97148
SMILES:O(C)c1c(O)c(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.841
InChIKey:LIELCHJKWOVYEW-UHFFFAOYSA-N
ID: 97149
SMILES:C(C1C(C)(C)CCC=C1C)c1c(CCCCC)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.707
CB1 binding score: -16.22
InChIKey:LFKZUJFIGQMXEP-UHFFFAOYSA-N
ID: 97150
SMILES:Oc1c(C=O)c(CCCCC)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.059
InChIKey:IVRCBDVTRVUPTL-UHFFFAOYSA-N
ID: 97151
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 97152
SMILES:C1(OC)C2C(C)CCC(C(C)=C)C2c2c(cc(CCCCC)cc2O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.255
InChIKey:YGDUJMLNWXIKFU-UHFFFAOYSA-N
ID: 97153
SMILES:C1C2(O1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -16.203
InChIKey:YHKQORWTTCKVJY-UHFFFAOYSA-N
ID: 97154
SMILES:CC(CCC=C(C)C)=CC1CC(=CCc2cc(OC)cc(C)c2O)CO1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.309
InChIKey:BLPVRZXAEZNLIC-UHFFFAOYSA-N
ID: 97155
SMILES:COC1C2C(COC(c3ccccc3)=O)(C)C(=O)CC2c2c(O)cc(CCCCC)cc21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.548
CB1 binding score: -16.416
InChIKey:QAIXNEGWNLOHLQ-UHFFFAOYSA-N
ID: 97156
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 97157
SMILES:C(CCC(C)=CCCC1(C)Oc2c(cc(O)cc2CCCCC)C=C1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -18.576
InChIKey:NHELTMDSPNDYML-UHFFFAOYSA-N
ID: 97158
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1(O)C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.56
InChIKey:VBPOXSBFZQHISD-UHFFFAOYSA-N
ID: 97159
SMILES:C1C(C)C2(C)C(C)(c3c(cc(CCCCC)cc3O)C2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.374
InChIKey:BMKJQNNJBXVWAW-UHFFFAOYSA-N
ID: 97160
SMILES:C1(O)C(C)(C)OC2=C(C(CCCCC)C(=O)C(C)(C)O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.407
CB1 binding score: -15.707
InChIKey:SUELBVFITSPDEV-UHFFFAOYSA-N
ID: 97161
SMILES:C(C)(O)(C)C1CCC(C)=CC1c1c(O)cc(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.637
InChIKey:CHUDUQRJNYLFSG-UHFFFAOYSA-N
ID: 97162
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 97163
SMILES:C1(C)(C)C2CC(O)C(C)=CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.125
InChIKey:PBCOSSIOLPRQDA-UHFFFAOYSA-N
ID: 97164
SMILES:Oc1cc(CC)cc(O)c1CC1C(C)=CCC2C1(C)CCC(=O)C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.808
InChIKey:FVHWTFITXZHXNG-UHFFFAOYSA-N
ID: 97165
SMILES:c1(C2CC(O)(C)C3C2C=C(C)CC3)c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.672
InChIKey:LGQOKURTGJYEBT-UHFFFAOYSA-N
ID: 97166
SMILES:C1(O)CCC2(C(C)(C)Oc3c2c(O)cc(CCCCC)c3O)C(C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -13.302
InChIKey:HMDHCZUFJZIYNE-UHFFFAOYSA-N
ID: 97167
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1C=C(CO)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N