ID: 114346
SMILES:COc1c2c(ccc1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.006
InChIKey:FSQORMJPEIALEJ-UHFFFAOYSA-N
ID: 114347
SMILES:C(CC1(C)C=Cc2c(O)cc(CCCC(=O)C)cc2O1)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.369
InChIKey:QIOHBPJWCURKOU-UHFFFAOYSA-N
ID: 114348
SMILES:c1(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.767
InChIKey:OGCCABVUOZBTQV-UHFFFAOYSA-N
ID: 114349
SMILES:c1c(CCc2ccccc2)cc(O)c(C2C=C(C)CCC2C(C)=C)c1OC
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 362.513
CB1 binding score: -18.298
InChIKey:ZUHUJJJOFJBQMI-UHFFFAOYSA-N
ID: 114350
SMILES:COC1=CC(=O)c2cc(CCCCC)cc(O)c2C1C(CCC=C(C)CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -15.805
InChIKey:AYTGLHFNUBFFKY-UHFFFAOYSA-N
ID: 114351
SMILES:C(CCc1cc(O)c(C2C=C(C)CCC2C(C)C)cc1)CCC(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -13.196
InChIKey:FNLRLCYCIJZDNV-UHFFFAOYSA-N
ID: 114352
SMILES:c12c(ccc(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.067
InChIKey:OBJJEVJNCDBGOD-UHFFFAOYSA-N
ID: 114353
SMILES:C1(C=C(C)C)(c2c(O)cc(CCCCC)cc2O)C=C(C)C2(CC(O)C(C)=CC2)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -15.981
InChIKey:YXXHIBVFDJBGKN-UHFFFAOYSA-N
ID: 114354
SMILES:C1C2C(C)=CCC1C(C)(C)Oc1cc(C(O)=O)cc(CCCCC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.383
InChIKey:STILFPXTHYCHNY-UHFFFAOYSA-N
ID: 114355
SMILES:C(c1cc(OC)c(O)cc1)C1CC(=O)OC(CCCCC)(C)C2(O)C1CC(C)=CC2CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -12.193
InChIKey:SXPDFBBQIGPMCI-UHFFFAOYSA-N
ID: 114356
SMILES:C1CC(C(C)(O)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.603
InChIKey:MUHCINLDLTYLCH-UHFFFAOYSA-N
ID: 114357
SMILES:Oc1c(CC=C(C)C)cc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.9
InChIKey:JEWKPLVVVNDWHZ-UHFFFAOYSA-N
ID: 114358
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C(O)(C(O)(C)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.187
InChIKey:OBTZRRKKRZSVBY-UHFFFAOYSA-N
ID: 114359
SMILES:COc1c(CC=C(C)C)c2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.068
InChIKey:XQPHHPMKKATDRS-UHFFFAOYSA-N
ID: 114360
SMILES:C(C1(C)C2SCc3c(O)cc(C)c(C)c3OC(C)(C)C1CC2)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.497
CB1 binding score: -15.047
InChIKey:FWKQXCUSWCZROS-UHFFFAOYSA-N
ID: 114361
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 114362
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114363
SMILES:C(Cc1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(O)(C)C=C12)CCC(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -12.075
InChIKey:YHXRVHZTVDWRTK-UHFFFAOYSA-N
ID: 114364
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 114365
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC3C(CC2)C(C)C3C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -13.383
InChIKey:CNRBRESUSUSBFS-UHFFFAOYSA-N
ID: 114366
SMILES:Oc1c(OC(=O)C)cc(CCCCC)cc1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.506
InChIKey:QJFPPSMZHBYSRQ-UHFFFAOYSA-N