ID: 105442
SMILES:C1C(C(=C)C)C(c2c(O)cc(O)c(C)c2)C(CCC)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -10.189
InChIKey:VZDMHGUHVIFZJS-UHFFFAOYSA-N
ID: 105443
SMILES:C1(=O)CC(C)C(OC(C)=O)C2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.367
InChIKey:LUQMEIYSHFTRCX-UHFFFAOYSA-N
ID: 105444
SMILES:CC1=CCC(C(C)=C)CC2C(C)(Oc3cc(CC=C)cc(O)c3C2CC(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -14.022
InChIKey:GTDJDXOWGXZXKX-UHFFFAOYSA-N
ID: 105445
SMILES:c12cc(C(C)(C(OC(C)=O)C)C)cc(OC)c1OC1C(COC(=O)C)(C(C)CC1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.502
CB1 binding score: -12.771
InChIKey:ASFLCBQGAGLFRM-UHFFFAOYSA-N
ID: 105446
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(=O)OC)C(OC)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.747
InChIKey:HENJVEXWSCKZTG-UHFFFAOYSA-N
ID: 105447
SMILES:C1=C(C)CC2C(C1)C(CO)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.356
InChIKey:WSIKJHKLNQLNRE-UHFFFAOYSA-N
ID: 105448
SMILES:C12(C)c3c(O)cc(CCCCC)cc3C(C(O)=O)(C1C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.334
InChIKey:MACMZAFBGXVDEQ-UHFFFAOYSA-N
ID: 105449
SMILES:c1c(CCCCC)cc2c(c1O)CC1(C(C)C(O)CC3(O)C1(C)CCCC3(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -12.258
InChIKey:CQFFBVUOSBEVJR-UHFFFAOYSA-N
ID: 105450
SMILES:Cc1cc2c(cc1)C(C)(C)Oc1c-2cc(CCCCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -17.615
InChIKey:NPXIWMRDZHDFSA-UHFFFAOYSA-N
ID: 105451
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C(O)C(C)=CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.379
InChIKey:SGSNKVYFBOJVAH-UHFFFAOYSA-N
ID: 105452
SMILES:Oc1c(C2C=C(C)CCC2C(C)=C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 105453
SMILES:C(c1c(O)c(C=O)c2c(c1)OC(C)(C)C1C(O)CC(C)CC12)C(CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.892
InChIKey:JYHNLGDCWNPLOE-UHFFFAOYSA-N
ID: 105454
SMILES:C1(OC(C)(C)C)Oc2c(c(O)cc(CCCC)c2)C=CC1(C)CCC(=O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.23
InChIKey:UDCFZYMZGXFWQC-UHFFFAOYSA-N
ID: 105455
SMILES:C1C2C(C)(C)CCCC2(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 105456
SMILES:O1c2c(c(O)cc(CCCC)c2)C2C=C(C)CCC2C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.746
InChIKey:DJTUHHYKWMQJBZ-UHFFFAOYSA-N
ID: 105457
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C=C(C(=O)O)CC(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -15.076
InChIKey:JGAUIBXGFBFCTG-UHFFFAOYSA-N
ID: 105458
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC12C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.436
InChIKey:WDUYLEGGKALMGA-UHFFFAOYSA-N
ID: 105459
SMILES:C1CC2C(c3c(O)cc(CCCCC)cc3OC2(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.935
InChIKey:MJXUOMRQWPNCBO-UHFFFAOYSA-N
ID: 105460
SMILES:c1(C=CC)cc(O)c2c(c1)OC(C)(C)C1=CCC(C)(O)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.193
InChIKey:VAAFSAOGEFLEJG-UHFFFAOYSA-N
ID: 105461
SMILES:C(Cc1c(C2C=C(C)CCC2C(C)=C)c(O)cc(C)c1O)(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: Not available
InChIKey:GSKVNFXVXJIYFG-UHFFFAOYSA-N
ID: 105462
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2OCc2ccc(O)c(O)c2)C(C(C)C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -14.74
InChIKey:UDPFKCRAXUCJEF-UHFFFAOYSA-N