ID: 8695
SMILES:Cc1cc(CC(=O)C)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -11.317
InChIKey:YYTAZBOJNSTEEZ-UHFFFAOYSA-N
ID: 8696
SMILES:C1C(COC(=O)C)=CC2c3c(O)cc(C(C)C(C(CC)C)O)c(C)c3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -14.466
InChIKey:LWDCMSDGZQRQTK-UHFFFAOYSA-N
ID: 8697
SMILES:C(CCC)Cc1cc(O)c2c(c1C=O)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.963
InChIKey:CXCUFUBHTUGCLR-UHFFFAOYSA-N
ID: 8698
SMILES:C1C(CCC=C(C)C)(C)C2C(C)(CC1)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.244
InChIKey:CYOQJYJRJGDYGJ-UHFFFAOYSA-N
ID: 8699
SMILES:C1=C(C)CCC(C(O)(C)C)C1c1c(O)cc(CCCCC)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.474
InChIKey:IDVWWLFEUSIZSP-UHFFFAOYSA-N
ID: 8700
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(CCC=C(C(O)CC=C(C)C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -15.108
InChIKey:GVBABEPRPFOATA-UHFFFAOYSA-N
ID: 8701
SMILES:c12c(C(C=C(C)C)=O)c(O)cc(O)c1C1C=C(C)C(OC(=O)C)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.471
CB1 binding score: -15.929
InChIKey:JFXFADNUADNQIZ-UHFFFAOYSA-N
ID: 8702
SMILES:C(CC(C)=CCCC1(C)C=Cc2cc(O)cc(C)c2O1)CC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.815
InChIKey:KATNVCHMOJEYCU-UHFFFAOYSA-N
ID: 8703
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -17.389
InChIKey:HODRCWKEJZQPDI-UHFFFAOYSA-N
ID: 8704
SMILES:Oc1c(O)c2c(cc1C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.186
InChIKey:XWMNHGVOSIHLHJ-UHFFFAOYSA-N
ID: 8705
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 8706
SMILES:C1(CCC(=CCc2c(O)cc(CCCCC)cc2O)C)C(=C)CCC(=O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.216
InChIKey:STTLJUREBRPTGE-UHFFFAOYSA-N
ID: 8707
SMILES:Oc1c(C=O)c(C(=O)O)c2c(c1)C1=C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.558
CB1 binding score: -15.374
InChIKey:UZVWYMSQOZWCKS-UHFFFAOYSA-N
ID: 8708
SMILES:C1(O)C(O)C(CCN)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 295.379
CB1 binding score: -14.302
InChIKey:ZCHTVNMIOQIUTF-UHFFFAOYSA-N
ID: 8709
SMILES:CC1=COc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)O2)CCC2C(C)(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -16.079
InChIKey:LRLUNGHYPMDXOK-UHFFFAOYSA-N
ID: 8710
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(OC)cc(CCCCCCCCCCCCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.766
CB1 binding score: -15.165
InChIKey:LEEHRGJCLNRJMZ-UHFFFAOYSA-N
ID: 8711
SMILES:C1=C2C(O)C(C)(C)CC2c2c(O)cc(C)cc2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: Not available
InChIKey:FCRZLFSQXCNAKD-UHFFFAOYSA-N
ID: 8712
SMILES:C(C(C)=CCC(C(C)Cc1cc(O)c(C2C=C(C)CCC2(C)C2CC(O)C(C)(C)O2)cc1O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -13.795
InChIKey:BTRIFFFASNTQMM-UHFFFAOYSA-N
ID: 8713
SMILES:C(CCCC)c1cc(O)c2c(c1C)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.986
InChIKey:AWCDWGZSQQVGRZ-UHFFFAOYSA-N
ID: 8714
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 8715
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N