ID: 61867
SMILES:C(CCCc1cc(OC)c(C2C(C(C)=C)CCC(C)=C2)c(OC)c1)CC=C(CCC=C(CCC=C(C)C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.853
CB1 binding score: -15.625
InChIKey:VBXMMPQRIOVZHA-UHFFFAOYSA-N
ID: 61868
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 61869
SMILES:C(=O)C1CCC2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.485
CB1 binding score: -15.645
InChIKey:XEJKFVYIRHFEIU-UHFFFAOYSA-N
ID: 61870
SMILES:c1(CC2C(=C)CC(c3c(O)cc(CCCCC)cc3O)C2C(C)C)c(O)cccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -14.435
InChIKey:LVAQTAJDWGDAHT-UHFFFAOYSA-N
ID: 61871
SMILES:C(=C)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.957
InChIKey:MTBKFELEBUQONK-UHFFFAOYSA-N
ID: 61872
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC(C)(C)C2C(O)=O)C2CC3(O)C(=C)CCC3C(C)CC2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -15.345
InChIKey:WAVWHCLYSKRAQR-UHFFFAOYSA-N
ID: 61873
SMILES:C12(C)Oc3c(cc(CCCCC)cc3O)CC(C)=CCCC(C)=CCC1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.835
InChIKey:LEDJERNCMDMUJF-UHFFFAOYSA-N
ID: 61874
SMILES:Oc1c(C(=O)C(C)CC)c2c(c3c1C(C)CC(C)O3)OC(C)(C)C1C2C=C(C(=O)OC)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -17.15
InChIKey:PFYDMPNZZBZZJL-UHFFFAOYSA-N
ID: 61875
SMILES:C1(O)C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C(O)=O)CC(O)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -14.365
InChIKey:VMPJHZSNYBOOJH-UHFFFAOYSA-N
ID: 61876
SMILES:Oc1c(CCCCC)cc(O)c2c1OC1(C)CCC3C(CC(CC(C)(C)O)=O)(C)OC3(C1)C2C=COC(C=C(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.75
CB1 binding score: -14.762
InChIKey:ASDNTIXKGZBFJS-UHFFFAOYSA-N
ID: 61877
SMILES:c1(O)c2c(cc(CC=C(C)CCC=C(C)C)c1)OC(C)(C)C1(Cl)CCC(C)(C)OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 433.032
CB1 binding score: -14.041
InChIKey:XINZGYBDILGZTM-UHFFFAOYSA-N
ID: 61878
SMILES:C(=C(C)CCC=C(C)C)COc1c(C(OC)=O)c(CCCCC)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -17.515
InChIKey:ODEXLYBUUJZMJQ-UHFFFAOYSA-N
ID: 61879
SMILES:OC(CCc1cc(OC)cc(CC=C(C)C)c1)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -15.517
InChIKey:UIHSJELCGYTGHQ-UHFFFAOYSA-N
ID: 61880
SMILES:O1C2C(O)C3C4(Oc5c(c(O)c(C(O)=O)c(CCCCC)c5)C14C)CCC2C(C)C3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.514
CB1 binding score: -13.208
InChIKey:YJVHISMDFPEIAH-UHFFFAOYSA-N
ID: 61881
SMILES:c12cc(CCCCC)cc(O)c1OCC(CCC=C(C)C)=C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.665
InChIKey:FZQFAMHLJGTBIJ-UHFFFAOYSA-N
ID: 61882
SMILES:C12C(c3ccccc3)cc(CCCCC)cc1OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.584
CB1 binding score: -14.501
InChIKey:RAGBVUNNOLCHBY-UHFFFAOYSA-N
ID: 61883
SMILES:C(C)(CCC(C)C)C(c1c(O)c(C=O)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Phloroglucinol-terpene hybrids
MW: 398.543
CB1 binding score: -13.441
InChIKey:FVACFNUFNFYZSY-UHFFFAOYSA-N
ID: 61884
SMILES:C(Cc1c(O)c2c(cc1)OC(C)(C)C1CC=C(C)CC12)(O)C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.695
InChIKey:NJTPDZKEYFRYBH-UHFFFAOYSA-N
ID: 61885
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 61886
SMILES:O=C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)C=C(Cl)Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 437.407
CB1 binding score: -12.119
InChIKey:SYXYDOONQZHFDP-UHFFFAOYSA-N
ID: 61887
SMILES:C(=Cc1c(Oc2ccc(C(C)OC)cc2)cc(O)c2c1OC(C)(C)C1C2C=C(C)CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.641
CB1 binding score: Not available
InChIKey:SAIMGKUTKHLJSQ-UHFFFAOYSA-N