ID: 68041
SMILES:C1CC(C)(C)C2=CC(C)CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -14.431
InChIKey:NRQBLNULKUOHJK-UHFFFAOYSA-N
ID: 68042
SMILES:CCCCCc1cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 68043
SMILES:C1c2c(O)cc(CCC)cc2OC(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -14.557
InChIKey:OGNNYYVWXQUESC-UHFFFAOYSA-N
ID: 68044
SMILES:C1C(C)(C)C2C(C=O)=CC1c1c(O)cc(CCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.248
InChIKey:JZWSPRHPCPZXSQ-UHFFFAOYSA-N
ID: 68045
SMILES:c1c2c(cc(O)c1CC(O)C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.745
InChIKey:CFLDVNFOQKSAMD-UHFFFAOYSA-N
ID: 68046
SMILES:OC1Cc2c(O)cc(CCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -19.121
InChIKey:CVXVLENENUQXCN-UHFFFAOYSA-N
ID: 68047
SMILES:C(O)C1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.979
InChIKey:BGFAVKWESQHCHC-UHFFFAOYSA-N
ID: 68048
SMILES:COc1c2c(cc(C(CC(C)=CO)CO)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.031
InChIKey:RTGMOFPDODOSQS-UHFFFAOYSA-N
ID: 68049
SMILES:CC12CC(c3c(O)cc(CCC)cc3OC1(C)C)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.994
InChIKey:AZOYLNCNNLCZST-UHFFFAOYSA-N
ID: 68050
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C)CC(c3cc(CC=C)c(O)c(OC)c3O)OC(C)(C)C1(O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.654
CB1 binding score: -12.751
InChIKey:ZUTXSPPSLQNIDI-UHFFFAOYSA-N
ID: 68051
SMILES:CC1(C)CC2C(C)CC3OC23C(C)C(C2c3c(O)cc(CCCCC)cc3OC2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -17.512
InChIKey:POJAYBWVDFZCEQ-UHFFFAOYSA-N
ID: 68052
SMILES:c1(CC=C(CCC=C(C)C)C)c(CCCCC)cc(O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.891
InChIKey:JFJAMLJGMDJCRJ-UHFFFAOYSA-N
ID: 68053
SMILES:c1(CCCCC)cc2c(c(O)c1C)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.546
InChIKey:KGCWPGPFKZEAGV-UHFFFAOYSA-N
ID: 68054
SMILES:C(C1CCC2C(=O)OC3c4c(O)cc(CCCCC)cc4OC13C2C)C1C(O)C(OC)OC1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.55
CB1 binding score: -14.857
InChIKey:CGMDKWIYYUNGFR-UHFFFAOYSA-N
ID: 68055
SMILES:C1C(=O)C(C)=CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c3)C2CC(C)CC=C1C(=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -15.331
InChIKey:YAHBLFCMFMZFDC-UHFFFAOYSA-N
ID: 68056
SMILES:C1(C(O)C(=C)c2c(O)c(C(C(O)CCC)=O)c(O)c(CC=C(C)C)c2)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -17.189
InChIKey:NWESYCBJTIKRFN-UHFFFAOYSA-N
ID: 68057
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 68058
SMILES:CC1(C)Oc2c(ccc(C)c2)C2C1CCC(C)=CCCC2=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.703
InChIKey:AQOARTDZFKUASW-UHFFFAOYSA-N
ID: 68059
SMILES:O(C)c1c(CC=C(C)C)cc(O)cc1C1C(C(C)=C)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.664
InChIKey:TXKBORVNSMOJSC-UHFFFAOYSA-N
ID: 68060
SMILES:C1=C(C(=O)O)C2C(O1)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -16.288
InChIKey:VSJOJLNKPXFARL-UHFFFAOYSA-N
ID: 68061
SMILES:C(C1=CC(=O)C2=C(C)C(O)CC(C(C)=C)C2c2c(O)cc(CC)cc21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.43
CB1 binding score: -16.591
InChIKey:SNJFTJOUVMHZBF-UHFFFAOYSA-N