ID: 82930
SMILES:C1=C(C2=CC(=O)C(CCC(C(CCC=C(C)C)=C)C)=C2)COC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.254
InChIKey:ZRBNKFZNNKMOON-UHFFFAOYSA-N
ID: 82931
SMILES:C1=C(C)C(CCc2c(CO)c(C3C=C(C)CCC3C(=C)C)c(C)cc2O)(C)C(C)(C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.68
CB1 binding score: -14.842
InChIKey:SJKXQQMNGXNTII-UHFFFAOYSA-N
ID: 82932
SMILES:c1(CC2C(C(=C)CCC=C(C)C)CCC(=C)C2)c(O)cc(O)cc1CCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.669
CB1 binding score: -16.2
InChIKey:AFWBMMBHPOYVGZ-UHFFFAOYSA-N
ID: 82933
SMILES:CC12CCCC(CO)C1(C(=O)O)Oc1ccc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -16.077
InChIKey:WCXOJBRNSAJBHQ-UHFFFAOYSA-N
ID: 82934
SMILES:c1(C(C)C)c(-c2c(C)cc(Oc3ccc(CCCC)cc3)c(O)c2C)c(O)c2c(c1C=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 582.781
CB1 binding score: -13.498
InChIKey:BNROYGWBHYEHNB-UHFFFAOYSA-N
ID: 82935
SMILES:C(CCC)Cc1cc2c(c(O)c1)CC1C3(C2)C(O)CCC(C)C3(C)C(O)C(C(O)(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -13.583
InChIKey:JSZKFHIFUFHVQV-UHFFFAOYSA-N
ID: 82936
SMILES:CC1(C)Oc2ccc(C#C)cc2C2C1C=C(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 252.357
CB1 binding score: -15.286
InChIKey:FQTDDQAYNNKMAZ-UHFFFAOYSA-N
ID: 82937
SMILES:C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1CCC(C(O)=O)=CC12)(=O)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.369
InChIKey:MXCATMYETMAMNB-UHFFFAOYSA-N
ID: 82938
SMILES:C1C2C(c3c(cc(CCCCCC)cc3O)OC2(C)C)C=C(COC(C)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.834
InChIKey:FLIQSOQAAQITNX-UHFFFAOYSA-N
ID: 82939
SMILES:c12cc(CCCCC)cc(O)c1OC1(C)C(C2CC(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.605
InChIKey:DKQADAOEDGZEPQ-UHFFFAOYSA-N
ID: 82940
SMILES:C1(C)(C)Cc2c(c(CO)c(CCCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -12.347
InChIKey:CRGBIZYFXZIHHT-UHFFFAOYSA-N
ID: 82941
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2=CC(C)(O)C(CCC(C)=CCCC(C(O)=O)=CC=C1)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.671
CB1 binding score: -14.908
InChIKey:URHAEYOBLNVJLK-UHFFFAOYSA-N
ID: 82942
SMILES:C1(C)(C)Oc2c(c(O)ccc2O)C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.988
InChIKey:FDECQIAQAVZRFF-UHFFFAOYSA-N
ID: 82943
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(CCC=C(C)C)C)(C2)OC(=O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -14.109
InChIKey:UBIXBIWBDCGJTK-UHFFFAOYSA-N
ID: 82944
SMILES:C(CCCOC(=O)c1cc(OC)c2c(c1)OC(C)(C)C1C2CC(=C)C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.817
InChIKey:XRMUKMDTRYTYOA-UHFFFAOYSA-N
ID: 82945
SMILES:C1C(C2CC(COC(c3ccccc3)=O)(C)CCC2)-c2c(cc(CCCCCO)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -14.625
InChIKey:USVBXIMTFJBAPA-UHFFFAOYSA-N
ID: 82946
SMILES:C1C(C)(C)C2C(C)(CC1)Oc1c(c(O)cc(CCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 302.458
CB1 binding score: -17.684
InChIKey:SQNFBZBGPYOMLU-UHFFFAOYSA-N
ID: 82947
SMILES:C(C)CCCc1cc(O)c2c(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: 82948
SMILES:c1(CCCCC)cc2c(c(O)c1C(O)=O)CC1C(C)(O2)CCC(C(C)(O)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -16.059
InChIKey:ZPIHZIYXLPDLCY-UHFFFAOYSA-N
ID: 82949
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -18.356
InChIKey:ZJPTYFKSUONYDF-UHFFFAOYSA-N
ID: 82950
SMILES:C(O)C1=CC2C(c3c(cc(CCCCC)cc3O)OC2(C)C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.951
InChIKey:JEEXZFGYKABYBK-UHFFFAOYSA-N