ID: 22828
SMILES:OC(C(CC(c1cc2c(cc1O)OC(C)(C)C1C2C=C(C)CC1)CCC=C(C)C)=O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -17.16
InChIKey:SQSFBQOGNBTKHN-UHFFFAOYSA-N
ID: 22829
SMILES:C(C)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.585
InChIKey:DNTBFILTGOCICF-UHFFFAOYSA-N
ID: 22830
SMILES:C(C(OC(=O)C)C)(C)=CCCC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.973
InChIKey:YWIAVBBPDRHMMR-UHFFFAOYSA-N
ID: 22831
SMILES:C1(O)C2(C)Oc3c(cc(CCCCC)cc3O)C3C(C)(C)C2C3C(C)(O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -13.584
InChIKey:DMCLXBQBPHPMQG-UHFFFAOYSA-N
ID: 22832
SMILES:C12c3c(O)c(C(OC)=O)c(C)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.943
InChIKey:LANVZNPMUYHEOO-UHFFFAOYSA-N
ID: 22833
SMILES:CC(=O)CCC1=CC2c3c(O)cc(CCCCC=C)c(O)c3OC(C)(C)C2CC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -14.135
InChIKey:RGIPLQOTOFUVBZ-UHFFFAOYSA-N
ID: 22834
SMILES:C(CCCCc1c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.433
InChIKey:UYPBKYXMQXNOFC-UHFFFAOYSA-N
ID: 22835
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 22836
SMILES:Cc1cc2c3c(c1)OC(C)(C)C1C3C(C(=O)CC1C)OC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.051
InChIKey:BILJUZIYFQTWFQ-UHFFFAOYSA-N
ID: 22837
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CC)cc2O)C=C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.049
InChIKey:PXXQRACZXXIYSA-UHFFFAOYSA-N
ID: 22838
SMILES:c1(OC)c(CCCCC)cc(O)c2c1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.881
InChIKey:GEAFFKJFASWNNJ-UHFFFAOYSA-N
ID: 22839
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 22840
SMILES:C(C)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 22841
SMILES:Oc1c2c(cc(CCCCC)c1)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
ID: 22842
SMILES:c1c(CCCC)cc2c(c1O)C1C=CC(CCC=C(C)C)(C)OC1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -15.968
InChIKey:AHKLOOPMRARRAP-UHFFFAOYSA-N
ID: 22843
SMILES:C1=C(CCCC(C)=CCc2c(OC)c(OC)cc(C)c2O)C(=C(C)C)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.855
InChIKey:BAMGBGWNUHDDDC-UHFFFAOYSA-N
ID: 22844
SMILES:CC12CC(=O)CC(C)C13CCC(C)(OC3=O)C2c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.646
InChIKey:NEPXLRUTFPBTFY-UHFFFAOYSA-N
ID: 22845
SMILES:CC(=CCCC1(C)C=Cc2c(cc(CCCCC)cc2O)O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 22846
SMILES:C1=C(C)CCc2c(COC(C)=O)c(CCCCC)cc(O)c2C1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.905
InChIKey:CHRDWDSQCBDCQP-UHFFFAOYSA-N
ID: 22847
SMILES:c1c(OC)c(CCCCC)c2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.871
InChIKey:CEFBCPPJWNRUGO-UHFFFAOYSA-N
ID: 22848
SMILES:c12c(O)c(C(=O)O)cc(CCCCC)c1OC(C)(C)c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1o2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.654
CB1 binding score: -16.141
InChIKey:JWWYEFDQIWRSKY-UHFFFAOYSA-N