ID: 14407
SMILES:C(O)C12C(OC(C(C)C)=O)CC(C)C3(C)C(=CC(=O)C(C(=C)C)=C3)C1Cc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.709
CB1 binding score: -15.72
InChIKey:DXCUECWKSWOPQG-UHFFFAOYSA-N
ID: 14408
SMILES:C(CC(CCO)c1cc2c(c(O)c1)C1C(CCC(C)C1)C(C)(C)O2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.722
InChIKey:PQJNBSAJNPBUPG-UHFFFAOYSA-N
ID: 14409
SMILES:c1(C2C(C(C)C)CCC(C)=C2)c(O)c(CC=C(C)C)c(O)c(Cc2c(C)cc(O)c(CC=C(CCC=C(C)C)C)c2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 570.858
CB1 binding score: -14.691
InChIKey:AXHJAWPLGYYROR-UHFFFAOYSA-N
ID: 14410
SMILES:CC1=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 14411
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)CC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -19.442
InChIKey:FRBSLGKYEBNHLH-UHFFFAOYSA-N
ID: 14412
SMILES:C(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 14413
SMILES:O1C(C)(C)C2CC(O)C(CO)=CC2c2c(O)c(C(=O)CC(C)C)c(O)c(OC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.475
CB1 binding score: -10.328
InChIKey:RDTBQGVPCJSJCB-UHFFFAOYSA-N
ID: 14414
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(COC(=O)C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.833
InChIKey:KUXDVXVRZZGDMG-UHFFFAOYSA-N
ID: 14415
SMILES:C1(C)=CC(c2ccc(CCCCC)c(O)c2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.701
InChIKey:GLWWBCAZFMPOBS-UHFFFAOYSA-N
ID: 14416
SMILES:C=C(C(C)(O)C)CCC(=CCc1c(O)cc(C)c(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.116
InChIKey:JTAIOJNGGNLMQO-UHFFFAOYSA-N
ID: 14417
SMILES:C(CCCc1cc2c(c(O)c1C(=O)OC)CC(CC=C(C)C)C(C)(C)O2)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.814
InChIKey:IACZMSXZXAFAFA-UHFFFAOYSA-N
ID: 14418
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 14419
SMILES:C1CCC(C)(C)C2Cc3c(O)cc(CCCC)cc3OC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 302.458
CB1 binding score: -17.684
InChIKey:SQNFBZBGPYOMLU-UHFFFAOYSA-N
ID: 14420
SMILES:C1(=O)C2(c3c(O)cc(CCCCC)cc3O1)C(C)CC(CC(C)C)(O)C2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.35
InChIKey:FGFCSWBRYMQDDX-UHFFFAOYSA-N
ID: 14421
SMILES:O1c2c(c(O)cc(CC)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.957
InChIKey:JJBMVXFZSLTKCL-UHFFFAOYSA-N
ID: 14422
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2)(C)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.67
InChIKey:YAZYCKCJRYEXHD-UHFFFAOYSA-N
ID: 14423
SMILES:c1(OC)cc(C2C=C(C)CCC2C(=C)C)c(O)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.604
InChIKey:YPUMBKRJVPZNCE-UHFFFAOYSA-N
ID: 14424
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(CO)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 14425
SMILES:c1(CCCC)cc2c(c(O)c1)CC1C2(O)C(O)CC(=C(C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.607
InChIKey:DBVGJLLQJVDIMH-UHFFFAOYSA-N
ID: 14426
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(OC)cc(O)c3)CCC(C)=CC(O)CC(C)=CC(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -15.951
InChIKey:IUOJDQTXFHISQI-UHFFFAOYSA-N
ID: 14427
SMILES:Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.889
InChIKey:UQZHCXRAKGTLRR-UHFFFAOYSA-N