ID: 45508
SMILES:C(C=C(CO)C)C=C1COc2c(ccc(CCCCC)c2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.37
InChIKey:YCLPEBCPLRJNCH-UHFFFAOYSA-N
ID: 45509
SMILES:C123CCC(C)=CC1C(C(C)C)CCC2(C)Oc1c3c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.641
InChIKey:ZKQDNOSBIATAEE-UHFFFAOYSA-N
ID: 45510
SMILES:O1C23C(CC1C)c1c(O)cc(CCCCC)cc1OC2(C)CCC2C(C)(C)CCCC23C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -15.257
InChIKey:OZBYUAXTNTZOOY-UHFFFAOYSA-N
ID: 45511
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C(O)(C1=O)C1(C)C3C(C(C)CC(OC(C)=O)C32)C2C=CC(C)(C)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.708
CB1 binding score: -12.621
InChIKey:OMHRNMDKVLNGHE-UHFFFAOYSA-N
ID: 45512
SMILES:c1(CC=C(CC=CC(=CCC2C(C)(C)O2)C)C)cc(O)cc(C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.85
InChIKey:SWNANWIXLAPUCM-UHFFFAOYSA-N
ID: 45513
SMILES:C1(=O)CC(C)C23CC(CC2)C(C)(CO)Oc2cc(C)cc(O)c2C13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -15.375
InChIKey:MYMMWPNIKKJCLC-UHFFFAOYSA-N
ID: 45514
SMILES:CCCCCc1cc(O)c(C2C(C(=C)CCC(O)C(C)C)CCC(CO)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.354
InChIKey:ARUGWGCMCHOWII-UHFFFAOYSA-N
ID: 45515
SMILES:CC1(O)C2C3C(c4c(cc(CCCC)cc4O)OC3(C)C=CC2C(C)C)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cannabinoids;Guaiane sesquiterpenoids
MW: 412.614
CB1 binding score: -11.791
InChIKey:AFCOFEWWDDMEQZ-UHFFFAOYSA-N
ID: 45516
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 45517
SMILES:C1C(O)Oc2cc(CCCCC)cc3c2C1(C(=O)O)CCC3=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.766
InChIKey:OHPPVENIJYKWTF-UHFFFAOYSA-N
ID: 45518
SMILES:c1(CCCCC)cc2c3c(c1)OC1(C)C(C3)C2C(C)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -15.406
InChIKey:NTGCIRMUZGQZIE-UHFFFAOYSA-N
ID: 45519
SMILES:C1=C(C)C2C(C=CC(C)=C2)C(CC=C(C)C)C(OC)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -16.061
InChIKey:LRBQZILXSZHLDE-UHFFFAOYSA-N
ID: 45520
SMILES:O=CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCCO)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.174
InChIKey:HVZLUQRVFIRJIJ-UHFFFAOYSA-N
ID: 45521
SMILES:c1(O)cc(CCCCC)c(O)c2c1C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.344
InChIKey:JOBXFRKEYIYOHE-UHFFFAOYSA-N
ID: 45522
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45523
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 45524
SMILES:COC(=O)C1=CCC(C(C)C)CC2C(C)(Oc3cc(CCCCC)cc(O)c31)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.459
InChIKey:BIFZZYRBQNXMDQ-UHFFFAOYSA-N
ID: 45525
SMILES:C1CC(C)=CC(c2c(OC)ccc(CCN(C)C)c2)C1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 45526
SMILES:O=C1C(C(C)C)(C)C(c2c(O)cc(CCCCC)cc2O)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.374
InChIKey:STACXDBKACFDFC-UHFFFAOYSA-N
ID: 45527
SMILES:C(CC)CCc1ccc2c(c1O)C1=C(C(C)(C)O2)CCC(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.499
InChIKey:GCYNJPOUQWCLPH-UHFFFAOYSA-N
ID: 45528
SMILES:C1(C(O)CC=C(C)C)(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.15
InChIKey:KUKYJEHBAHVULB-UHFFFAOYSA-N