ID: 126316
SMILES:c1(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 126317
SMILES:CC1=CC2c3c(cc(C)cc3OC(C)(C)C(Cl)CC1)CC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.915
CB1 binding score: -12.589
InChIKey:KJHWMMLSDZRLCY-UHFFFAOYSA-N
ID: 126318
SMILES:CC1(C)OC1CCC1(C)C=Cc2c(O)cc(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -19.337
InChIKey:CPBHEJIKHIHMDY-UHFFFAOYSA-N
ID: 126319
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 126320
SMILES:C1CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.522
InChIKey:XTHXQACBFDXOKH-UHFFFAOYSA-N
ID: 126321
SMILES:C12C(C)(O)CCC1C(C)(C)Oc1c2cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 262.349
CB1 binding score: -17.426
InChIKey:GHAYDLCAXDHSAL-UHFFFAOYSA-N
ID: 126322
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(CO)CCC2C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.114
InChIKey:DNWZUWPOUFZDFA-UHFFFAOYSA-N
ID: 126323
SMILES:C1C2OC2(C)CC2C1C(C)(C)Oc1cc(C)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.438
InChIKey:GTWBBLULJSWLMJ-UHFFFAOYSA-N
ID: 126324
SMILES:O(C(C)(C1C(c2ccc(O)cc2O)(OC)C=C(CCC=C(C)C)CC1)C)C(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -12.772
InChIKey:CBMYPXBUQPWUBI-UHFFFAOYSA-N
ID: 126325
SMILES:c1(CCCCC)cc2c(c(O)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 126326
SMILES:C1(C)=CC2c3c(c(O)cc(CCCCC)c3)C(=O)C13C(CC=C(C(OC)=O)C3)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -16.943
InChIKey:DLBMZAFHZZUKHC-UHFFFAOYSA-N
ID: 126327
SMILES:c1(O)cc(O)c(CC=C(CCC=C(COC(=O)C)C)C)cc1CCCCCC
Pathway: Polyketides
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 388.548
CB1 binding score: -14.511
InChIKey:QYEKXKVPUYXVJA-UHFFFAOYSA-N
ID: 126328
SMILES:C1(c2c3c(C)ccc(C(C)C)cc-3c(C)c2)C(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.632
CB1 binding score: -9.199
InChIKey:QEARHGRXBWXQEX-UHFFFAOYSA-N
ID: 126329
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(C)(C)C3CCC(C)C132
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.026
InChIKey:AUMASGCPWWEEGN-UHFFFAOYSA-N
ID: 126330
SMILES:O=c1ccc(C2C=C(C)CCC2C(=C)C)c(O)c(C2OCC(CCC=C(C)C)=C2)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -15.929
InChIKey:CSNCNOQSKKELMT-UHFFFAOYSA-N
ID: 126331
SMILES:C1(C)(C)C2CCC1(C)C(O)C(=O)c1c(O)cc(CCCCC)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.069
InChIKey:UJLBMYWEQCFLFJ-UHFFFAOYSA-N
ID: 126332
SMILES:C12C(O)(C(C)C)CCC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.502
InChIKey:WAJHIMQLAAOKMD-UHFFFAOYSA-N
ID: 126333
SMILES:C(=C)(C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 126334
SMILES:c1(=O)c2c(O)cc(CCCCC)cc2OC(CCC=C(C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.376
InChIKey:AAZSXXIEAYXFSH-UHFFFAOYSA-N
ID: 126335
SMILES:c1(O)c(C(OC)=O)c(OC)c(CCCCC)c(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -12.147
InChIKey:XHRRNHSCEZYUII-UHFFFAOYSA-N
ID: 126336
SMILES:Oc1c(CC=C(CCC=C(C=O)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.431
InChIKey:YOPNEMNEITVXDO-UHFFFAOYSA-N