ID: 3865
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(=O)O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 3866
SMILES:C(=O)C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)c(C=O)c(C)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -17.488
InChIKey:YGOAJCCOHBGSIG-UHFFFAOYSA-N
ID: 3867
SMILES:c1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 228.335
CB1 binding score: -18.767
InChIKey:FFUBTKRHDZNPRU-UHFFFAOYSA-N
ID: 3868
SMILES:CC1(C)Oc2c(C(OC)=O)c(O)cc(CCCCC)c2C2C1C(=O)C(CCCCC)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -14.511
InChIKey:ISHYUMKQDGBRLY-UHFFFAOYSA-N
ID: 3869
SMILES:C12C(C(C)C)CC=C(C)C1(Cc1c(O)cc(CCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.005
InChIKey:YEXISJPIDLOGJL-UHFFFAOYSA-N
ID: 3870
SMILES:c1(C)cc(O)c(C(=O)COC(=O)CCCCCCCCCC(CC)C)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.758
CB1 binding score: -14.071
InChIKey:MWLATHZNGXCPTR-UHFFFAOYSA-N
ID: 3871
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 3872
SMILES:c12c(cc(CCCCC)cc1O)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: 3873
SMILES:Cc1cc(O)c2c(c1C(=O)OC)OC(C)(C)C1C2CC(C)(O)CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -16.603
InChIKey:OHTNTFNKRBZJAI-UHFFFAOYSA-N
ID: 3874
SMILES:CC(C)=CCc1c(-c2ccc(O)cc2)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -14.009
InChIKey:MDZMEDYIZIYFDD-UHFFFAOYSA-N
ID: 3875
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2O)C2=C1C(O)C(O)C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -14.441
InChIKey:UKZJWRCKUTWOHK-UHFFFAOYSA-N
ID: 3876
SMILES:c1(C(=O)C(C)C)cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.69
InChIKey:MLEZQRVWQXTRIW-UHFFFAOYSA-N
ID: 3877
SMILES:CCCCCc1cc(O)c(C2C(C(=C)C)CC=C(CCC=C(C)C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.882
InChIKey:DNSPTINNDSRBBA-UHFFFAOYSA-N
ID: 3878
SMILES:CC(=CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -19.034
InChIKey:SKFPSWUXWVYQEV-UHFFFAOYSA-N
ID: 3879
SMILES:C(C12C(C(c3c(O)cc(CCCCC)c(O)c3)(C)CCC1C)CCC(=C)C2)(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -14.738
InChIKey:BFLYNIXLIVYZGK-UHFFFAOYSA-N
ID: 3880
SMILES:C=C(C)C1CCC(=C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.279
InChIKey:KLYPAQJXUITNGB-UHFFFAOYSA-N
ID: 3881
SMILES:CC1(C)Oc2c(c(O)cc(CCc3ccc(O)cc3)c2)C(CC2=CCCC(C)=C2)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.577
CB1 binding score: Not available
InChIKey:GWWKSQPXNSZLDG-UHFFFAOYSA-N
ID: 3882
SMILES:Oc1c(C=O)c(CCC)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.706
InChIKey:BRXQGSCNJVOECT-UHFFFAOYSA-N
ID: 3883
SMILES:C12C(C(C)C)C(c3c(O)cc(CCCC)cc3O1)CC(C)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -14.474
InChIKey:YQNUMHVLXWHROA-UHFFFAOYSA-N
ID: 3884
SMILES:C(CC(c1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)=O)(C(=C)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.408
InChIKey:GCOHNUPAQBQYJR-UHFFFAOYSA-N
ID: 3885
SMILES:O(C)c1cc(CCCCC)cc2c1C1C=C(C(=O)O)C3CC13C(C)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.62
InChIKey:UGOVZHNZQLXNLT-UHFFFAOYSA-N