ID: 20707
SMILES:Oc1c2c(c(C(=O)CC(C)C)c(O)c1)OC(CCC=C(C)C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.106
InChIKey:OQCAMYAVSBFMTL-UHFFFAOYSA-N
ID: 20708
SMILES:C(CCCc1cc(OC)c(C2C=C(C)CCC2C(C)=C)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -19.394
InChIKey:KGRDDHLANLEPSJ-UHFFFAOYSA-N
ID: 20709
SMILES:CCCCCCc1cc(O)c2c3c1OC(C)(C)C1CCC(C)(C1)C3O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.838
InChIKey:GBGBWMCQFLJSKB-UHFFFAOYSA-N
ID: 20710
SMILES:c1(C(O)C=C(C)C)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -12.152
InChIKey:OWGATTDRRMTMDC-UHFFFAOYSA-N
ID: 20711
SMILES:C1C(C)=CC(c2c(O)cc(CC)cc2O)C(C(CCCC(C)C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -14.967
InChIKey:OXNYSFNNIYJRRR-UHFFFAOYSA-N
ID: 20712
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1C(=O)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.276
InChIKey:IYLQXCKXEFSETH-UHFFFAOYSA-N
ID: 20713
SMILES:C1(C)=CCCC(=C)C2C(CC1)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.103
InChIKey:CQGIDMUKNMQXCY-UHFFFAOYSA-N
ID: 20714
SMILES:O1c2c(c(O)c(C=O)c(CO)c2)C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -18.658
InChIKey:LTZXNONLGVSYMH-UHFFFAOYSA-N
ID: 20715
SMILES:O(C)CC1=C2C(OC(=O)CCc3ccc(OC)c(OC)c3)CC(C)=CC(=O)C1(C(C)=C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.508
CB1 binding score: -9.666
InChIKey:DCJJNKAQTWOALQ-UHFFFAOYSA-N
ID: 20716
SMILES:c1(CCCCO)cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.825
InChIKey:DQFYDHRSWRVWJY-UHFFFAOYSA-N
ID: 20717
SMILES:C1CC(CCCC(C)=CC(CC(C)C)=O)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 400.603
CB1 binding score: -16.983
InChIKey:YKGBHIDMHRUCEV-UHFFFAOYSA-N
ID: 20718
SMILES:C12C(O)c3c(O)cc(CCCCC)cc3OC1(C)CCC1C2CCC(C)=CCCC1C(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -15.539
InChIKey:SMVCGRYLKMDMOA-UHFFFAOYSA-N
ID: 20719
SMILES:C1C2(Cl)C(CC(Cl)C1(C)Cl)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 419.82
CB1 binding score: -14.625
InChIKey:DFSWCJGUBCDALG-UHFFFAOYSA-N
ID: 20720
SMILES:Oc1c(C(=O)CC(C)C)c2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.831
InChIKey:YHIVFUIEZCDTGJ-UHFFFAOYSA-N
ID: 20721
SMILES:C1CC2(O)C(C)(CCC(=O)C2(C)C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.588
InChIKey:KKGXHPRJTHJUGE-UHFFFAOYSA-N
ID: 20722
SMILES:C1(C)=CC(c2c(OC)ccc(OC)c2)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -17.814
InChIKey:OFJSDHLGLZNWGY-UHFFFAOYSA-N
ID: 20723
SMILES:C(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 20724
SMILES:C1(c2c(CCCCC)cc(O)cc2O)=C2C3C(C(C)CC2C=C(COC)CC3)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.797
InChIKey:FHPLYRGNCVIXNE-UHFFFAOYSA-N
ID: 20725
SMILES:C(C)(=O)C1CC=C(C)C(O)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -17.947
InChIKey:WWJQUVWFDPGVRJ-UHFFFAOYSA-N
ID: 20726
SMILES:Oc1cc(CCCCC)cc2c1C1CC(C)(O2)CC2(OC(C(C)=CC)=O)OC12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.825
InChIKey:ACOQJROLJOSHHP-UHFFFAOYSA-N
ID: 20727
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC2C1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.243
InChIKey:QTGRWAAXZFBAFE-UHFFFAOYSA-N