ID: 122158
SMILES:C1(OC)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)(O)C3C2(CC(C)(C)C3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.378
InChIKey:PRHOXKUMLNOQEQ-UHFFFAOYSA-N
ID: 122159
SMILES:C=C(C)C1CCC2(C)CC1c1cc(CCCC)c(O)c(C=O)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.64
InChIKey:ROFWVTIPHXOTCX-UHFFFAOYSA-N
ID: 122160
SMILES:C1C(C(C)=C)C(c2cccc(CCN(C)C)c2)C=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 283.459
CB1 binding score: -18.316
InChIKey:NCZMJELKEZQIFV-UHFFFAOYSA-N
ID: 122161
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(O)(C)CCC1C(O)(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.848
InChIKey:GODMIXAMIQIMFE-UHFFFAOYSA-N
ID: 122162
SMILES:C(C(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O)=CC(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.425
InChIKey:YOXFIKQPAMQIMJ-UHFFFAOYSA-N
ID: 122163
SMILES:C1(O)C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.955
InChIKey:UKTDGUHOBZBFHV-UHFFFAOYSA-N
ID: 122164
SMILES:OC1(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 122165
SMILES:CC(C)C(c1cc(O)c2c(c1)OC1(C)CCC3C(C)(CCCC3(C)C)C1=C2)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.167
InChIKey:AMKBKGHKDPRFNQ-UHFFFAOYSA-N
ID: 122166
SMILES:C(CCCCCCc1cc2c(c(O)c1)C1=C(C)C(=O)OC(C)(C)C1C2)=C(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -17.508
InChIKey:TWQINBULWSAYIX-UHFFFAOYSA-N
ID: 122167
SMILES:C1C(C)=CC(c2c(O)ccc(CC=CCC)c2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -17.123
InChIKey:AKJBFIGTNSGDEN-UHFFFAOYSA-N
ID: 122168
SMILES:C(Oc1cc(CCCCC)cc2c1C1CC(C)=CCC1c1cccc(c1)O2)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.578
CB1 binding score: -15.62
InChIKey:JRBVZFFRVRUXHM-UHFFFAOYSA-N
ID: 122169
SMILES:CC(C)=CCCC1(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 122170
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)c1c-2cc(C)cc1C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -16.351
InChIKey:OQTFBJUEXNQRQB-UHFFFAOYSA-N
ID: 122171
SMILES:OCC(CCC=C(C)C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.652
InChIKey:YGSDIXSCKNPHAP-UHFFFAOYSA-N
ID: 122172
SMILES:CC1(C)OCC(C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.374
InChIKey:HYXJNNVQDLJRNW-UHFFFAOYSA-N
ID: 122173
SMILES:CC(CC(C=C(C)C)=O)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -13.633
InChIKey:SXCZXYAVUDFZND-UHFFFAOYSA-N
ID: 122174
SMILES:CCc1cc(O)c(C2C(C(C)=C)CC=C(C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.979
InChIKey:ULASTLGOVDSGEJ-UHFFFAOYSA-N
ID: 122175
SMILES:C12C=C(C(OC)=O)CCC1C(C)(C)Oc1c2c(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -13.774
InChIKey:MTQULOZATSFCCM-UHFFFAOYSA-N
ID: 122176
SMILES:C(C)c1c(O)cc(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -17.652
InChIKey:GFZBDSMMEKEACG-UHFFFAOYSA-N
ID: 122177
SMILES:c1(C(C2=C(C3C(C(C)=C)CCC(C)=C3)C(=O)O3)C(C)C3(O)O2)c(O)cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.483
CB1 binding score: -11.787
InChIKey:FUMXZJLSMZIFOU-UHFFFAOYSA-N
ID: 122178
SMILES:C1(=O)C(C)=CC2C(C1)C(C)(C)Oc1c2c(O)cc(CCC(=O)O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -15.51
InChIKey:NTMFARFYDQKQOP-UHFFFAOYSA-N