ID: 113275
SMILES:c1(C)cc(C2C(C(C)=C)C(c3c(O)cc(CCCCC)cc3O)CC(C)=C2)c(O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -14.509
InChIKey:PUOZKDDJLXWOJS-UHFFFAOYSA-N
ID: 113276
SMILES:C(C)(=O)Oc1cc(C)cc(O)c1C1(COC(=O)C(C)C)CCC(C(C)=C)C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -12.408
InChIKey:BYQPZAUIDRVPOU-UHFFFAOYSA-N
ID: 113277
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 113278
SMILES:c1c(CC=C(CCC=C(CO)C)C)c(O)cc(CCCCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.083
InChIKey:CUWVCPCRNIPQCV-UHFFFAOYSA-N
ID: 113279
SMILES:c1c(COC(=O)N(C)C)c2c(cc1OC)OC(CCC=C(C)C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 359.466
CB1 binding score: -12.831
InChIKey:QZTLQVDUIKBCOJ-UHFFFAOYSA-N
ID: 113280
SMILES:C1C(C)C(=O)OC1c1c(OC(C)=O)cc(CCCCC)cc1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -17.029
InChIKey:PUNUKMSCKXKQEM-UHFFFAOYSA-N
ID: 113281
SMILES:C1CC(C(C)(O)C)OC1(C12CCC(C)=CC1c1c(cc(CCCCC)cc1OC)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.816
InChIKey:ZPZUESBBFLAJOL-UHFFFAOYSA-N
ID: 113282
SMILES:c1(C(O)CC(=NNC(N)=N)C(C)C)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.55
CB1 binding score: -17.035
InChIKey:HRIDHKLDVIRHLZ-UHFFFAOYSA-N
ID: 113283
SMILES:C(CCc1ccc2c(c1)OC(C)(C)C1CC=C(C)CC12)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.178
InChIKey:CGSQGQBTRXMWOC-UHFFFAOYSA-N
ID: 113284
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1=C(C(=O)C(C)C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: Not available
InChIKey:YJMNACSIZOPQBW-UHFFFAOYSA-N
ID: 113285
SMILES:C1(C(C)C)(OCC)CC(OC)C(C)=CC1c1c(O)c(CC=C(C)C)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.502
InChIKey:BUMJAWLOKINDGG-UHFFFAOYSA-N
ID: 113286
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: 113287
SMILES:C12(O)C(C=CC(C)=C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.968
InChIKey:VWSMGTICRPLDMN-UHFFFAOYSA-N
ID: 113288
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C2C(C)(CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.791
InChIKey:VSQGBNUBIDZRPJ-UHFFFAOYSA-N
ID: 113289
SMILES:Oc1c(O)c2c(c(Cl)c1CCCCC)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.913
CB1 binding score: -17.459
InChIKey:QUWDDBGBMIMZJK-UHFFFAOYSA-N
ID: 113290
SMILES:C1(C)(C)OC2=C(C(=O)C(CCCCCC)=C2O)CCC2(C)Oc3ccc(O)cc3CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.553
CB1 binding score: -14.2
InChIKey:JMYWTBLKXSIOAE-UHFFFAOYSA-N
ID: 113291
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)cc3OC(=O)C)OC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.814
InChIKey:UNKUEHYRFOGRIR-UHFFFAOYSA-N
ID: 113292
SMILES:c1(CC(=O)OCC)ccc2c(c1)OC(C)(C)C1C(O)CC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.389
InChIKey:ILYBEOHBTIPNQG-UHFFFAOYSA-N
ID: 113293
SMILES:c1c(O)cc2c(c1)C(CC(=O)C)C1C(C(C)(C)O2)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.849
InChIKey:WGUNXOGZYVJROA-UHFFFAOYSA-N
ID: 113294
SMILES:C(C)(C1C(c2c(O)cc(CCCCC)cc2OC)CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.147
InChIKey:DFVSPDQRMLXUTH-UHFFFAOYSA-N
ID: 113295
SMILES:COc1cc(CCCCC)c(C(=O)OC2CC3(C)C(CC(O)C(=O)C3C)C2(C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -13.874
InChIKey:DLIHKZUQLUGXHC-UHFFFAOYSA-N