ID: 66487
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 66488
SMILES:C(C)(=CCCC1(C)C2C(=COc3ccccc3)C3CC4C3(C(OC)=O)Oc3c(c(O)c(C=O)c(O)c32)C(CC(C)C)C41)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 586.725
CB1 binding score: -16.453
InChIKey:WMUPOAXKDHZEBH-UHFFFAOYSA-N
ID: 66489
SMILES:C(OC)(c1c(O)c2c(cc1C)OC(C)(C)C1C2C(OC)C(C)C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -12.545
InChIKey:BRRCXDFGTVNHQH-UHFFFAOYSA-N
ID: 66490
SMILES:C1(C(O)=O)CCC2=C1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.772
InChIKey:DGNYERACXDBOOZ-UHFFFAOYSA-N
ID: 66491
SMILES:C1=CCC(C)=CCC2C(C)(C)Oc3cc(CCCCC)c(OC(C)=O)c321
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.088
InChIKey:GDHSRJAIRKAZDB-UHFFFAOYSA-N
ID: 66492
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)=CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.979
InChIKey:RPIAMKIGKMZKPE-UHFFFAOYSA-N
ID: 66493
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 66494
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.484
InChIKey:SFQCHTBSAMCNBB-UHFFFAOYSA-N
ID: 66495
SMILES:C(CCCCCc1cc2c(c(O)c1C=O)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.034
InChIKey:DNJNDKQOKOVWKM-UHFFFAOYSA-N
ID: 66496
SMILES:C(=C(C)C)CC=C(C)C=CCC(=CCc1c(O)c(C)cc(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.339
InChIKey:YJIJQYKRECIVSO-UHFFFAOYSA-N
ID: 66497
SMILES:C(c1c(CCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)(O)C1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.62
InChIKey:NXVXHNYIJBVPPK-UHFFFAOYSA-N
ID: 66498
SMILES:OC1C2(C)CCC(C(C)C=O)C2c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.902
InChIKey:MTKCYSIDGGQYAR-UHFFFAOYSA-N
ID: 66499
SMILES:C1CC(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.813
InChIKey:LISQMXYEJUYUCR-UHFFFAOYSA-N
ID: 66500
SMILES:OC1C2C3(C(O)CC(O)C2(C)C(OC)=O)COC(O)C3(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.554
CB1 binding score: Not available
InChIKey:JAXVJJHIEKJKHH-UHFFFAOYSA-N
ID: 66501
SMILES:C(CC)Cc1ccc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.047
InChIKey:CCDUBXOBPUUCKA-UHFFFAOYSA-N
ID: 66502
SMILES:c1c(O)cc(CCCCC)c(C2C(C(=C)C)CCC(CO)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.927
InChIKey:LMWBULJRPZXLOU-UHFFFAOYSA-N
ID: 66503
SMILES:C(CCc1c2c(c(O)c(-c3ccc(O)cc3)c1)OC(C)(C)C1C2CC(C)=CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.566
CB1 binding score: -15.297
InChIKey:NYKFJWIKCXBWKM-UHFFFAOYSA-N
ID: 66504
SMILES:c1c(CCCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 314.513
CB1 binding score: -17.334
InChIKey:LEDFMVBKTGJRMR-UHFFFAOYSA-N
ID: 66505
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 66506
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CC2=C(C(O)CCC2=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.375
InChIKey:NBLGWEPJZKXJPR-UHFFFAOYSA-N
ID: 66507
SMILES:C(C)(=CCCC1(C)Oc2c(c(O)cc(CCC)c2)-c2c1c(C)ccc2C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -16.254
InChIKey:IRXFVIQNBNUUQI-UHFFFAOYSA-N