ID: 62392
SMILES:O=C1Oc2c(cc(OCC=C(CCC3OC3(C)C)C)cc2CCCC)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.084
InChIKey:VYMKRTSERNAKNT-UHFFFAOYSA-N
ID: 62393
SMILES:O1c2c(cc(CCCCC)cc2O)-c2cc(O)c(CC=C(CCC=C(C)C)C)cc2C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.712
CB1 binding score: -13.39
InChIKey:CVYVSUBWPRAFNL-UHFFFAOYSA-N
ID: 62394
SMILES:C(CCCc1cc2c(c(O)c1C)OC(C)(C)C1CCC(C)(O)C=C21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.659
InChIKey:OMOAYSRZMAIYAF-UHFFFAOYSA-N
ID: 62395
SMILES:C1=C(C)CCC(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.358
InChIKey:VXJTXJOKIPKJFI-UHFFFAOYSA-N
ID: 62396
SMILES:C(CCCCC)c1cc(O)c2c(c1)OC(C)(C)C1=CC3(C)C(C4C(C)(C)C4C13O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -14.611
InChIKey:AITPWSDOTOHEDP-UHFFFAOYSA-N
ID: 62397
SMILES:CCCCCc1cc(O)c2c(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: 62398
SMILES:Oc1ccc(O)c(C2C(O)C(c3c(O)cc(CCCCC)cc3O)OC(C)(C)C2=CC=C(CC=CC(C)(C)O)C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 566.735
CB1 binding score: -13.785
InChIKey:WTQKNMPACXNDGJ-UHFFFAOYSA-N
ID: 62399
SMILES:C(CCc1cc(O)c(C2C(C(O)(CCC=C(C)C)C)CCC(C)=C2)c(O)c1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -16.257
InChIKey:PMLUNWCDPANDNI-UHFFFAOYSA-N
ID: 62400
SMILES:CC1(CC=C(C)C)C2C(c3ccc(O)cc3)CC(=O)C(C)(C)OC1(O)C(C)=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -18.6
InChIKey:PWVRGLJZXPFKAK-UHFFFAOYSA-N
ID: 62401
SMILES:Oc1cc(CCC)cc2c1C1C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 62402
SMILES:C(CCCC)CCCCCCCCc1c(C(=O)O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -14.739
InChIKey:OEAYRHLQFSTXSO-UHFFFAOYSA-N
ID: 62403
SMILES:c1c(CCCC)cc(O)c(C2C(C(O)(C)C)CCC(O)(C)C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.472
CB1 binding score: -16.506
InChIKey:OUOFGEBPLQNLMU-UHFFFAOYSA-N
ID: 62404
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CC(O)C1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.072
InChIKey:DJCKLUPKZRLTPE-UHFFFAOYSA-N
ID: 62405
SMILES:C(CCC=C(C)C)(C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 62406
SMILES:CCCCCc1cc2c(cc1O)C1(O)C(C(C)(C)O2)C=CC(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.815
InChIKey:RNRGPWWCQJXPJP-UHFFFAOYSA-N
ID: 62407
SMILES:C1C(C(C)=C)C(c2c(O)cc(CCC)cc2O)C=C(C)CCC2OC2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -16.608
InChIKey:PARSISACJMTALZ-UHFFFAOYSA-N
ID: 62408
SMILES:C(C(CCCCO)C)CCc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -17.817
InChIKey:KELBGBPAQQTXAK-UHFFFAOYSA-N
ID: 62409
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.619
InChIKey:MMZAEMNNHWYQKW-UHFFFAOYSA-N
ID: 62410
SMILES:C(CCCC)c1c2c(ccc1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.739
InChIKey:ZZTFZXSLWCGMDM-UHFFFAOYSA-N
ID: 62411
SMILES:C(=C)C1(C)C=C2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.346
InChIKey:FTHTUYWWSHIISZ-UHFFFAOYSA-N
ID: 62412
SMILES:C(CCCC)c1cc(O)c2c(c1O)C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.533
InChIKey:MBXAIRIUNYLGKW-UHFFFAOYSA-N