ID: 49288
SMILES:C12=CC(C(C)C)C=CC1(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.078
InChIKey:WJTCXARWWHGZRX-UHFFFAOYSA-N
ID: 49289
SMILES:C1=C(C)CCC(O)C(C)(C)Oc2cc(O)c(C(O)=O)c(CCCCC)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -13.582
InChIKey:GXXPWXVZWUUEJO-UHFFFAOYSA-N
ID: 49290
SMILES:C12(Cl)C(O)C(Cl)C3(C)CC1c1c(cc(CCCCC)cc1O)OC2(C)C(C)CO3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 443.411
CB1 binding score: -15.552
InChIKey:YKQYQBFUGNFHIU-UHFFFAOYSA-N
ID: 49291
SMILES:C1(Oc2cc(CCCCC)ccc2C2C=C(C(CCC=C(C)C)C)OC2)OC(CO)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 504.664
CB1 binding score: -13.792
InChIKey:PUOUSLHAXOLUEP-UHFFFAOYSA-N
ID: 49292
SMILES:c1(CCC(=O)OC(C(C)(C)O)CCC(=CC)C)cc(O)c(CC=C(C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -12.672
InChIKey:YOYLSNDGKRMBJO-UHFFFAOYSA-N
ID: 49293
SMILES:C1(C(=C)CO)C(c2c(O)cc(CCCCC)cc2)CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -13.311
InChIKey:RSRWAHTWKWGMGD-UHFFFAOYSA-N
ID: 49294
SMILES:COc1c2c(c(COC(=O)C)c(OC(=O)CCCCCCCC=C)c1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 512.687
CB1 binding score: -14.937
InChIKey:ANBNMFKZUWZWBR-UHFFFAOYSA-N
ID: 49295
SMILES:C(CCCC)c1cc(O)c(CC=C(C)CC(C=C(CCC=C(C)C)C)O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.603
CB1 binding score: -18.107
InChIKey:FMOIMMFSJNNXQB-UHFFFAOYSA-N
ID: 49296
SMILES:CC1(C)C2CC=C(C)CC2c2c(cc(CCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 49297
SMILES:CC1(C)C2CC(=O)C(CO)=CC2c2c(ccc(=O)cc2CCC(C)(O)C(CO)O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.486
CB1 binding score: -13.803
InChIKey:FMJAWLOKCLGWDW-UHFFFAOYSA-N
ID: 49298
SMILES:Oc1cc(CC)cc(O)c1CC=C(C)CCCC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -16.643
InChIKey:CGAASXUOPKIEFQ-UHFFFAOYSA-N
ID: 49299
SMILES:CCC1=CCC2(C)CCC3C(C)(C)Oc4cc(CCCCC)cc(O)c4C132
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.438
InChIKey:WNTQOEPNIKQHHB-UHFFFAOYSA-N
ID: 49300
SMILES:COc1cc(CCCCCC)cc(O)c1CC1=C(C)CCC2C(C)(C)CC(O)CC21C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.657
CB1 binding score: -14.072
InChIKey:LZEVJSWHXLJGOI-UHFFFAOYSA-N
ID: 49301
SMILES:C1(=O)C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 49302
SMILES:C(C1C2C(CC(=O)C1)C(c1c(O)c(C(O)=O)c(CCCCC)cc1O)O2)(C)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.46
CB1 binding score: -11.886
InChIKey:UYIBTUOFLKQSHQ-UHFFFAOYSA-N
ID: 49303
SMILES:c12c(O)cc(CCCCC)c3c1OC(C)(C)C1C3C(C2(C)C)CC(O)C(COC)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.583
InChIKey:HFYFMRJDXUTXMT-UHFFFAOYSA-N
ID: 49304
SMILES:C1(C)C2(O)C(C3=C(C)C(=O)OC3(O)C1)c1c(cc(CCCC)cc1O)OC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.432
CB1 binding score: -13.423
InChIKey:MXDSYUQWTBGQSB-UHFFFAOYSA-N
ID: 49305
SMILES:CCCc1cc(C2C=C(C)CCC2C(C)=C)c(O)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.693
InChIKey:NTKIABPKBTWCCW-UHFFFAOYSA-N
ID: 49306
SMILES:C(CCC(=CCO)C)c1ccc(C2(C)CC(C(=C)C)CC(CCC=C(C)C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.653
CB1 binding score: -13.681
InChIKey:DIXGWRBSFWYAEJ-UHFFFAOYSA-N
ID: 49307
SMILES:C1c2c(OS(=O)(O)=O)cc(CCCCC)cc2OC(C=CC=C(C)C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.506
CB1 binding score: -11.609
InChIKey:SKVYKFXQDONFRT-UHFFFAOYSA-N
ID: 49308
SMILES:C1C2C3(C)CC(c4c(O)cc(CCCC)cc4O)OC(C)(C)C3C1C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: Not available
InChIKey:DOUPLQHAZCELHY-UHFFFAOYSA-N