ID: 51283
SMILES:C1=C(COC(C)=O)CCC2C(C)(Oc3c2c(O)cc(CCCCC)c3)C1OC1OC(CO)C(O)C(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.618
CB1 binding score: -14.136
InChIKey:TZBPSWYSPGYVJB-UHFFFAOYSA-N
ID: 51284
SMILES:CC(C)CCCc1cc2c(c(O)c1)C1CC(C(=C)C)C(CCC(C)=C)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.379
InChIKey:ZBILZGQVIKDZBW-UHFFFAOYSA-N
ID: 51285
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -17.892
InChIKey:YCSIDAUWCFLSQK-UHFFFAOYSA-N
ID: 51286
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)C(C)(O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.334
InChIKey:GCIHUSZAYFSIEA-UHFFFAOYSA-N
ID: 51287
SMILES:O=C1C2=C(c3c(O)cc(CCCCC)c(C(=O)CCC)c3O)CC=C(C)C2CC(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.619
CB1 binding score: Not available
InChIKey:FHBAYRKEMPNFIM-UHFFFAOYSA-N
ID: 51288
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2)C2C(C2(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -15.952
InChIKey:HSTDVMVDAIYCOF-UHFFFAOYSA-N
ID: 51289
SMILES:C(CCCC)c1cc(O)c(CC2C(=C)CCC(C)C2=C)c(OS(O)(O)=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.549
CB1 binding score: -13.798
InChIKey:VFLCDXWGQHMFBX-UHFFFAOYSA-N
ID: 51290
SMILES:CC(OC1CC(C)C2(C)C3c4c(O)cc(CCCCC)cc4OC(CC2C(C)(C)C1)O3)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -14.041
InChIKey:YHRNAMHKRGURAG-UHFFFAOYSA-N
ID: 51291
SMILES:c1(OC)c(CCCCCC)cc2c(c1)C1=C(C(C)(C)O2)CCC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.91
InChIKey:XYZRSQLLLPMQEZ-UHFFFAOYSA-N
ID: 51292
SMILES:C1(O)C2C(C)(CCC1OC(C)=O)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.697
InChIKey:SFIPCFDSUNSSOQ-UHFFFAOYSA-N
ID: 51293
SMILES:C=C(C1CCC(C)=CC1c1c(O)cc(CC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 51294
SMILES:C(C(c1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2)C)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -12.258
InChIKey:DBOFYMSNFOMYFH-UHFFFAOYSA-N
ID: 51295
SMILES:c1c(CCCCC)cc2c(c1O)OC(C)(C)c1ccc(C)c-2c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -16.033
InChIKey:VCCDSOALCNHCBM-UHFFFAOYSA-N
ID: 51296
SMILES:C1(=O)C2(C3OC3(C)C1)C(C)(C)Oc1cc(CCCCCC)c(C(OC)=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -15.12
InChIKey:QDHRZTQZBIYLNN-UHFFFAOYSA-N
ID: 51297
SMILES:O1c2c(cc(CCCCC)cc2O)C(O)C2C1C(=O)CC2C(C)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.414
InChIKey:IKNXHQPFBPQAEQ-UHFFFAOYSA-N
ID: 51298
SMILES:C(=O)(C1(C)Oc2c(cc(CCCCC)cc2O)C1)OCC=C(C)CCC=C(C)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -17.07
InChIKey:CNISUDFIWFSWTI-UHFFFAOYSA-N
ID: 51299
SMILES:C1C(OC(C(=CC)C)=O)CC2(C)CC3C(C(C)(C)Oc4cc(CCC)cc(O)c43)CCC2(C)C1OC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.714
CB1 binding score: -15.382
InChIKey:BHNJJWKYIYVWFF-UHFFFAOYSA-N
ID: 51300
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1C=O)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 408.582
CB1 binding score: -16.549
InChIKey:XFRCVKRERPFZTA-UHFFFAOYSA-N
ID: 51301
SMILES:C(c1cccc(COc2c3c(cc(C)c2)OC(C)(C)C(O)C3)c1)CC(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -15.754
InChIKey:CVQXUWJGEHETGX-UHFFFAOYSA-N
ID: 51302
SMILES:CC1C(O)C2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.008
InChIKey:GBHLDTUEFUWEAP-UHFFFAOYSA-N
ID: 51303
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N