ID: 76462
SMILES:C(Cc1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.427
CB1 binding score: -16.234
InChIKey:MFIAJKGDUAEQDF-UHFFFAOYSA-N
ID: 76463
SMILES:COc1c(C=CC=O)c(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -17.354
InChIKey:MWAGAELFNBMHOH-UHFFFAOYSA-N
ID: 76464
SMILES:C(C(C)C)CCc1c2c(ccc1C)OC(C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -17.902
InChIKey:NWNYVSKDVRVQEY-UHFFFAOYSA-N
ID: 76465
SMILES:O(c1ccc2c(c1)C1C(C(C)(C)O2)CCC(CO)=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.007
InChIKey:YZWBIXHJQIAKLT-UHFFFAOYSA-N
ID: 76466
SMILES:C(CC=C(C)C)C(C)=CCc1c(O)c(C(=O)O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 344.495
CB1 binding score: -19.654
InChIKey:TURBAOCYHPEVOM-UHFFFAOYSA-N
ID: 76467
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C(=O)O1)CCC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.066
InChIKey:QGVJIEUEABQCQB-UHFFFAOYSA-N
ID: 76468
SMILES:C(C)(CCC=C(C)CCC=C(C)C)=CCc1cc(O)c(CC(=O)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Merosesquiterpenoids;Tetraketide meroterpenoids
MW: 372.505
CB1 binding score: -18.306
InChIKey:BDRGSNYWOXCBFU-UHFFFAOYSA-N
ID: 76469
SMILES:COc1ccc(O)c(C2C(C(C)=C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 76470
SMILES:C(Cc1c(O)cc(CC)cc1O)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 76471
SMILES:C1CC2(C(C)=CCC3C(C)(COC(C)=O)OC=C(CCC=C(C)C)C23)C1C(C)(C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.503
InChIKey:CSMANOCDYOHZQA-UHFFFAOYSA-N
ID: 76472
SMILES:C1CC2C(C)(C)Oc3c(c(OC(=O)C)ccc3OC)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.974
InChIKey:VRVFPLJTDFKPPG-UHFFFAOYSA-N
ID: 76473
SMILES:CCCCCc1cc(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: 76474
SMILES:c1(O)c(C=O)c(CCCCC)cc2c1C1C(C(C)(C)O2)CC(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.211
InChIKey:MTANIBBFCLIODP-UHFFFAOYSA-N
ID: 76475
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(COC(C)=O)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 76476
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C3OC3(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.791
InChIKey:VSQGBNUBIDZRPJ-UHFFFAOYSA-N
ID: 76477
SMILES:Oc1cc(CCC)cc2c1C1C=C(C(ON)=O)CCC(C(C)C)C1o2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 345.439
CB1 binding score: -14.709
InChIKey:QMJASUGXRCNPIA-UHFFFAOYSA-N
ID: 76478
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 76479
SMILES:Oc1c(C(C(C)=CC)C(C)C(=O)CC)c(O)c(C(=O)C)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: Not available
InChIKey:GMJDMJUGIREZNH-UHFFFAOYSA-N
ID: 76480
SMILES:CC(=CCCC(=CCc1c(O)cc(CCCCC)c(O)c1OC)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -17.003
InChIKey:XIUBJVUUYFEVJM-UHFFFAOYSA-N
ID: 76481
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1(O)C2(O)C(=O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.433
CB1 binding score: -16.502
InChIKey:BPKIEJQQJGWTHL-UHFFFAOYSA-N
ID: 76482
SMILES:C1(C)(C)C2C(O)c3c(O)cc(CCCCC)cc3C(C=C1C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -14.61
InChIKey:JKYCTPXKCYUBDM-UHFFFAOYSA-N