ID: 33643
SMILES:C(Cc1c(CCCC)cc(C2C(C(C)=C)CCC(C)=C2)c(C)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -12.391
InChIKey:AMMSBOVXUCJXSG-UHFFFAOYSA-N
ID: 33644
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 33645
SMILES:C(CCc1cc2c(c(OS(O)(=O)=O)c1)C1CC(C)=CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.533
CB1 binding score: -16.725
InChIKey:LLJYZJLJRMOGEK-UHFFFAOYSA-N
ID: 33646
SMILES:c1(O)c2c(cc(CCC(C(O)CO)(C)O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -15.87
InChIKey:UPSNPSASSVKBHO-UHFFFAOYSA-N
ID: 33647
SMILES:C(c1c(CCCC)cc(O)c2c1OC1(C)CCC3C(C)(C1C2)CC(OC(C)=O)C(C(=C)C)O3)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -14.599
InChIKey:PCXJEXILEJQNDK-UHFFFAOYSA-N
ID: 33648
SMILES:C1(COC(=O)C)=CCOC2c3c(O)cc(CCCC)cc3OC1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.368
CB1 binding score: -14.605
InChIKey:NVULRNRGIRVWTO-UHFFFAOYSA-N
ID: 33649
SMILES:C(=CC(CC(CC)C)C)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.961
InChIKey:XHFIXIMDTIFSSG-UHFFFAOYSA-N
ID: 33650
SMILES:c1(CCCC)cc(O)c2c(c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.879
InChIKey:IXZUQKJFDLWXNQ-UHFFFAOYSA-N
ID: 33651
SMILES:C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C2CCC(C#N)(C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.625
CB1 binding score: -17.13
InChIKey:CRJNXFNJQFHMJM-UHFFFAOYSA-N
ID: 33652
SMILES:C(CC)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1C1=CC(C)(C)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.718
CB1 binding score: -15.183
InChIKey:RMACROSCUZWLBN-UHFFFAOYSA-N
ID: 33653
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 33654
SMILES:c1ccc(CNC(=O)C(C2CCC3(C)C(c4c(cc(CCCCC)cc4O)OC3(C)C)C2)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 477.689
CB1 binding score: -14.592
InChIKey:WREPGFBZVGIIFM-UHFFFAOYSA-N
ID: 33655
SMILES:c1(OC)c(O)c(CCCC)cc2c1C1(C(=O)C(CCC)=C(O)C1=O)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.616
CB1 binding score: -13.536
InChIKey:WHPMZSGBVLPSLX-UHFFFAOYSA-N
ID: 33656
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 33657
SMILES:C12C(=O)C=C(C)CCC1C(C)(C)Oc1cc(C)c(CCCCC)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.73
InChIKey:OSMZWNNGRKFWGK-UHFFFAOYSA-N
ID: 33658
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 33659
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.687
InChIKey:RGXKCMQANRHRCO-UHFFFAOYSA-N
ID: 33660
SMILES:CC(C)=CCC1C(c2c(O)cc(O)c3c2OC2(C)CCC(C(=C)C)OC23)C(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -10.113
InChIKey:PDCNMGGJGZOFCO-UHFFFAOYSA-N
ID: 33661
SMILES:OC(Cc1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.509
InChIKey:XRZGQYUWKUWHIA-UHFFFAOYSA-N
ID: 33662
SMILES:C1(O)C(C)=CCC(C(O)(C)C)C1c1c(O)cc(CC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -14.802
InChIKey:VNESAUMGTOTTAG-UHFFFAOYSA-N
ID: 33663
SMILES:c1(CCCCCC)cc(O)c(CC=C(C)CC(=O)C=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 344.495
CB1 binding score: -15.159
InChIKey:MNYDMVOUZIUKTD-UHFFFAOYSA-N