ID: 119449
SMILES:Oc1cc2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.879
InChIKey:QUTSEXVWDYCFLT-UHFFFAOYSA-N
ID: 119450
SMILES:CC1(C)C2(CCC(C)=CC2)c2c(cc(CCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.608
InChIKey:QATZCQMZABAYOF-UHFFFAOYSA-N
ID: 119451
SMILES:C1CC2C(C)(C)Oc3cc(C)cc(O)c3C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 119452
SMILES:O(c1cccc(C2C=C(C)CCC2C(C)=C)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.07
InChIKey:GOPCVFILFYCAHC-UHFFFAOYSA-N
ID: 119453
SMILES:c12c(cc(OC)cc1C)C1C3(OC(=O)C2CC1)OC3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -14.221
InChIKey:BCEVTYCXCCJMSP-UHFFFAOYSA-N
ID: 119454
SMILES:C(CC)CCc1c(C#CC(C)=C)c(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -16.413
InChIKey:LYQOJDVRSPDXCP-UHFFFAOYSA-N
ID: 119455
SMILES:C12=C(C(C)(C)Oc3cc(CCCCC)cc(O)c31)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.728
InChIKey:RECLSNODOVFMMU-UHFFFAOYSA-N
ID: 119456
SMILES:O1c2c(c(O)cc(C)c2)C2C(C1(C)C)CC(CC=C(C)C)C2(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Polyprenylated cyclic polyketides (Hop meroterpenoids)
MW: 396.615
CB1 binding score: -14.724
InChIKey:JKFHFAYVVFHSGW-UHFFFAOYSA-N
ID: 119457
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -20.991
InChIKey:VUUOQMIMZAXLBK-UHFFFAOYSA-N
ID: 119458
SMILES:C1C2CC(OO)C(C(=C)C)CCC2(C)Oc2cc(CCCCC)cc(O)c2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -13.826
InChIKey:GRFMBVPGHGEDCK-UHFFFAOYSA-N
ID: 119459
SMILES:c1(CC(O)C(C)(O)C)c(N)c(=O)cc(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 373.493
CB1 binding score: -14.605
InChIKey:TUPRGEGZLOLABZ-UHFFFAOYSA-N
ID: 119460
SMILES:C1CC(O)CC2C1(C)Oc1c(c(CCCCC)cc(O)c1)C2CC(=O)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.967
InChIKey:GQZOMVPTQSSHDV-UHFFFAOYSA-N
ID: 119461
SMILES:C(C)(C)C(=C)Cc1c(O)cc(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -11.984
InChIKey:NSAGFWYRLZJVKF-UHFFFAOYSA-N
ID: 119462
SMILES:C1C2(C)C(Cc3c(O)ccc(CCCCCC)c3)C(C(C)=C)OC(C)(C1OC(C)=O)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -13.721
InChIKey:QUMRQLFYSYGUTM-UHFFFAOYSA-N
ID: 119463
SMILES:CC12OC3=C(C(=O)C(C)C)c4c(O)cc(CCCCC)cc4OC(C)(C)C3CC1C=CC(=O)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -14.499
InChIKey:IBZQJQWFDMZVAJ-UHFFFAOYSA-N
ID: 119464
SMILES:COc1c(COC2C(O)C(O)C(O)C(CO)O2)c(O)c2c(c1)OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.526
CB1 binding score: -15.923
InChIKey:SQMWPRWCXHYMCF-UHFFFAOYSA-N
ID: 119465
SMILES:CC(=C1C2C(C(OC)=O)(CC1)C1Oc3c(c(O)cc(C)c3)C1C2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.024
InChIKey:BHQPHTRVAYWFDS-UHFFFAOYSA-N
ID: 119466
SMILES:C12(C)CCC(C)=CC1c1c(O)cc(C)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.439
InChIKey:FATPOFSCQSRFAO-UHFFFAOYSA-N
ID: 119467
SMILES:C(CCCc1cc(O)c2c(c1)OC(CO)(CCC(=O)C(C)=C)C2)CC1(C)C=Cc2c(c(C)c(C)c(O)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.666
CB1 binding score: -15.519
InChIKey:IPKDZDAUHQYQGJ-UHFFFAOYSA-N
ID: 119468
SMILES:C1(C)=CCCC2(C)C1=Cc1c(O)c(O)c(C(C)(C)CC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.877
InChIKey:IILIRAJFMCMELV-UHFFFAOYSA-N
ID: 119469
SMILES:c1(O)c2c(cc(CCCCC)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