ID: 102187
SMILES:C1(=O)C2(Oc3c1c(OC)cc(CCCCC)c3)C(C)=CCC(C(C)=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -16.193
InChIKey:IRDVREIWRDDINC-UHFFFAOYSA-N
ID: 102188
SMILES:c1(CC=C(C)CCC(C2(C)OC(=O)C3CCC(=C(C)C)CC32)C)cc(O)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.333
InChIKey:SEMPHKPOOMLPCT-UHFFFAOYSA-N
ID: 102189
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(=C2C)OCC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.066
InChIKey:UJBKEPXRIDRVDR-UHFFFAOYSA-N
ID: 102190
SMILES:C1(=O)C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.334
InChIKey:LMTQDQLMOBKYNY-UHFFFAOYSA-N
ID: 102191
SMILES:CC(=O)OCC(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -17.531
InChIKey:VLZIRTYJIJXJEH-UHFFFAOYSA-N
ID: 102192
SMILES:c1c(CC(N2C(C)CCC2C(C)=C)C2=C(O)C(=O)C(C)=CC2=O)cc(CC=C(C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 449.591
CB1 binding score: -13.127
InChIKey:YDRYVGNCDOLSDA-UHFFFAOYSA-N
ID: 102193
SMILES:c1(CCCc2ccccc2)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.513
CB1 binding score: -19.111
InChIKey:WXYSXCKLHVPERM-UHFFFAOYSA-N
ID: 102194
SMILES:c12c(cc(CCCCC)cc1O)cc1c(c2O)C(=O)CC(C)(CCC=C(C)CCC=C(C)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -15.929
InChIKey:DBPLDBRDUJSXAQ-UHFFFAOYSA-N
ID: 102195
SMILES:O=C(O)c1c2c(cc(OC)c1CCCCC)OC(C)(C)C1CCC(C)CC21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.089
InChIKey:XYBATKRMJMDWDS-UHFFFAOYSA-N
ID: 102196
SMILES:C(C=C)c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N
ID: 102197
SMILES:c1c(CCCCC)cc(C2C(C(C)(C)O)CC(O)C(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -12.764
InChIKey:ODPPBSOMZUONGM-UHFFFAOYSA-N
ID: 102198
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.943
InChIKey:YFZDAIKSUYYPEE-UHFFFAOYSA-N
ID: 102199
SMILES:c1c(N)cc(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 243.35
CB1 binding score: -16.655
InChIKey:HMJIEIUVRAYCJS-UHFFFAOYSA-N
ID: 102200
SMILES:C(=O)C1=C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.508
InChIKey:NUKCLLVNXPSJFR-UHFFFAOYSA-N
ID: 102201
SMILES:c1cc(CC)c2c(c1O)C1C=C(C)CCC3C(C)(CC(O)C1C(C)(C)O2)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -12.69
InChIKey:JDPBBWDEFNIUGI-UHFFFAOYSA-N
ID: 102202
SMILES:c1c(O)cc(CCC)c(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.559
InChIKey:UNKCBUFGTIWVPT-UHFFFAOYSA-N
ID: 102203
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C2=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.025
InChIKey:XEVIYGNSBNWCJT-UHFFFAOYSA-N
ID: 102204
SMILES:c1(O)cc(CCCCC)cc2c1-c1c(O)cc(CCCCCCCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.836
CB1 binding score: -15.374
InChIKey:XFLVKLGBENXFFE-UHFFFAOYSA-N
ID: 102205
SMILES:C1OC1(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.929
InChIKey:NJNWAFZXRIVSKA-UHFFFAOYSA-N
ID: 102206
SMILES:c1c2c(c(OC)c(O)c1)C1CC(=C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.084
InChIKey:UVYAXBOOWVNSBC-UHFFFAOYSA-N
ID: 102207
SMILES:CC(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N