ID: 71611
SMILES:O(CCOC)c1ccc2c(c1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.14
InChIKey:ODAGXUHUMLNYDB-UHFFFAOYSA-N
ID: 71612
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 71613
SMILES:C(c1cc(CCCCC)cc(O)c1)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.792
InChIKey:LTMDLXPPVFFIFP-UHFFFAOYSA-N
ID: 71614
SMILES:Cc1cc2c(cc1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 71615
SMILES:C(CCC(=CCc1c(O)c(C(=O)O)cc(CCCCC)c1)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 71616
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C3OC(C=C(C)C)CC(O)(C)C1CC32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.242
InChIKey:AEUROEICEDJVBY-UHFFFAOYSA-N
ID: 71617
SMILES:CCCCCc1cc2c(c(O)c1C(O)=O)CC1C(C)(O2)CCC(C(C)(O)CCC=C(C)C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.611
CB1 binding score: -15.243
InChIKey:NQXGROXFPIKEGX-UHFFFAOYSA-N
ID: 71618
SMILES:COc1c(CCCCC)cc2c(c1O)C1C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.752
InChIKey:ZYXQGFVKCRMWOJ-UHFFFAOYSA-N
ID: 71619
SMILES:OC1(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3OC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.748
InChIKey:GTRZQPALKREAPU-UHFFFAOYSA-N
ID: 71620
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: 71621
SMILES:C(C=C(C)C)CC(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: 71622
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 71623
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: 71624
SMILES:C(CC)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.957
InChIKey:OANGEIYPAQYPQV-UHFFFAOYSA-N
ID: 71625
SMILES:CC(CC)Cc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.74
InChIKey:LSYWNNCTYNCONH-UHFFFAOYSA-N
ID: 71626
SMILES:COc1c2c(c3c(c1)OC(C)(C)C1C3C=C(C)CC1)c(=O)c1ccc(O)c3c1C(C)(C)OC3O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.542
CB1 binding score: -16.207
InChIKey:MYXVLCAAWAMPJR-UHFFFAOYSA-N
ID: 71627
SMILES:CCCCCc1cc2c(c(O)c1)C1C(OC)(O1)C(C)(C)C(CC=C(C)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.638
InChIKey:ZZPORDVKCUMGFY-UHFFFAOYSA-N
ID: 71628
SMILES:c1(O)c2c(cc(CCCCCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.994
InChIKey:RSHHRAXMOZULOO-UHFFFAOYSA-N
ID: 71629
SMILES:C1C2(C)Oc3cc(CCCCC)cc(O)c3C3C2OC(C=C(C)C3=O)CC(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -16.408
InChIKey:CSXDEGCYXFXUIM-UHFFFAOYSA-N
ID: 71630
SMILES:C1(CCCC(C)COC)(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -14.084
InChIKey:XRFXUXIKKLUAHI-UHFFFAOYSA-N
ID: 71631
SMILES:c1c(C)c2c3c(c1)c(C)cc(c3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.449
CB1 binding score: -15.351
InChIKey:NFFCHKAWUOLSDK-UHFFFAOYSA-N