ID: 42883
SMILES:C(C)(C)=CCc1c(O)cc(CCCCC)c(C=O)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.049
InChIKey:UTQODHOHWHAWHC-UHFFFAOYSA-N
ID: 42884
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(CC(C)=CCC1)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.306
InChIKey:ZKPBCQMNCFRWRV-UHFFFAOYSA-N
ID: 42885
SMILES:CC(=CCCC1(C)Oc2c(C)cc(Oc3cc(O)c(CC=C(CCC=C(C)C)C)c(O)c3)cc2C2CC(CO)=CCC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 586.813
CB1 binding score: -15.434
InChIKey:JXXYMNQRWPUQQF-UHFFFAOYSA-N
ID: 42886
SMILES:c1c(CCCC)cc2c(c1O)OC(C)(C)C1C2(C)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -12.133
InChIKey:ZIDNARUAMCCFKT-UHFFFAOYSA-N
ID: 42887
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)c(O)c(c3)C2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.997
InChIKey:IXGHYUQIEXNHGA-UHFFFAOYSA-N
ID: 42888
SMILES:c1c(C)c(-c2oc(=O)c(C3C=C(C)CCC3C(CC=CC(O)(C)C)=C)c(OC)c2)ccc1OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.612
CB1 binding score: -17.185
InChIKey:YKKXJEGPIPFMAJ-UHFFFAOYSA-N
ID: 42889
SMILES:Oc1cc(OC(=O)C)cc2c1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: Not available
InChIKey:GNEAMKPFOXUJAX-UHFFFAOYSA-N
ID: 42890
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.232
InChIKey:VOSIUROXKQMZTJ-UHFFFAOYSA-N
ID: 42891
SMILES:C1(COC(Cc2cc(OC)c(O)c(OC)c2)=O)=CCC2c3c(cc(CCCCC)cc3O)OC(C(=C)C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.665
CB1 binding score: -16.438
InChIKey:JUFUZTRXSMZVHE-UHFFFAOYSA-N
ID: 42892
SMILES:Oc1c(C2C(C(C)C)CCC(C)=C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 42893
SMILES:C12C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 42894
SMILES:C12C(C(O)C(C)=CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.546
InChIKey:BBIHENVVOQODBF-UHFFFAOYSA-N
ID: 42895
SMILES:c1(CCC)c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -19.667
InChIKey:FAVCTJGKHFHFHJ-UHFFFAOYSA-N
ID: 42896
SMILES:CC(C(=O)c1cc2c(cc1)OC(C)(C)C1CCC(C)=CC1C(C(C)=C)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.367
InChIKey:IKKGXCVKIBEPEB-UHFFFAOYSA-N
ID: 42897
SMILES:C12C(C)(Oc3c1ccc(CCCCC)c3)CCC(C(O)(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.777
InChIKey:VAWIAWOPXRVOPN-UHFFFAOYSA-N
ID: 42898
SMILES:C1C(C#C)CCC(C)(CC(c2c(O)c(C(=O)O)c(CCCCC)cc2)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -14.924
InChIKey:DZBPSQPEWYTDHL-UHFFFAOYSA-N
ID: 42899
SMILES:O=C1C(=O)C(C)=C(C=O)C(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.445
CB1 binding score: -12.641
InChIKey:CRXLVXICISXTQN-UHFFFAOYSA-N
ID: 42900
SMILES:C1(=O)C=C(C)C23C(C(C)(C)Oc4cc(CCCCC)cc(O)c41)C(C2)C(C)=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: -14.858
InChIKey:YISJDZXHVIAORC-UHFFFAOYSA-N
ID: 42901
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 42902
SMILES:C12(C)CCCC3(C)C1C(c1c(cc(CCCCC)cc1O)O2)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.504
InChIKey:GKSTWBFRBWYEQD-UHFFFAOYSA-N
ID: 42903
SMILES:CC1=CC(c2c(OC)cccc2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.382
InChIKey:PIWOIVDTYQHIGV-UHFFFAOYSA-N