ID: 41623
SMILES:CCC(O)CCc1cc2c(c(O)c1)C1CC(C)(O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.329
InChIKey:LONMOIMGNMKWBE-UHFFFAOYSA-N
ID: 41624
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C(O)=O)CCC1(C)O2)C=CC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -13.889
InChIKey:IXJVDUIHKJBBGT-UHFFFAOYSA-N
ID: 41625
SMILES:C(O)(CC1(C)C2C3(CC(C4(C)OC4)Oc4cccc(O)c4-3)C=CC2CC(C)=C1)CCCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -14.92
InChIKey:UHEYDPOKDDFMFT-UHFFFAOYSA-N
ID: 41626
SMILES:c1(C(=O)CC(C)C)cc(O)c2c(c1)OC(C)(C)C1C2CC(C(O)=O)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -15.379
InChIKey:ANPYNPWDHJCTLH-UHFFFAOYSA-N
ID: 41627
SMILES:O1c2c(c(O)cc(C)c2)C2C=CCCC=C(C)CCC1C2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -12.694
InChIKey:YEBVXKKTLOLHDZ-UHFFFAOYSA-N
ID: 41628
SMILES:OC(=O)C(C)C1C(c2c(O)c(O)cc(CCCC)c2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.62
InChIKey:LZASPNLNFQWQQA-UHFFFAOYSA-N
ID: 41629
SMILES:CC1(C)C2CC=C(Cc3c(OC(=O)C)c(OC)cc(CCCC)c3)C(C)C2(C)CCC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -14.879
InChIKey:GSBKUNHBXHXDJS-UHFFFAOYSA-N
ID: 41630
SMILES:C12C(CCC(C)=CC1O)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -17.401
InChIKey:YTFIYQAKEHZACO-UHFFFAOYSA-N
ID: 41631
SMILES:C1(O)C(=O)C=C2C(C)(C1C)C1C(C(C)(C)Oc3ccc(OCc4ccccc4)cc31)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.533
CB1 binding score: -14.935
InChIKey:QNFQSTXQAPROKV-UHFFFAOYSA-N
ID: 41632
SMILES:c1(C(C)CCOc2cc(OC)c3c(c2)OCO3)cc2c(c(C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -14.449
InChIKey:YQOJTHMMRYAMSR-UHFFFAOYSA-N
ID: 41633
SMILES:C(CCOC)c1c(O)c(CC2C(C(=C)C)CCC(C)=C2)c(O)c(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -12.947
InChIKey:ICUNPBOZEUEMJT-UHFFFAOYSA-N
ID: 41634
SMILES:O(CC)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.873
InChIKey:GYSOMHVHWFXMDZ-UHFFFAOYSA-N
ID: 41635
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N
ID: 41636
SMILES:CC1C2=C(C(O)(CO)CC(C)=CC3C(C(C)(C)Oc4cc(CCCCC)cc(OS(=O)(O)=O)c42)C3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.688
CB1 binding score: -17.46
InChIKey:BUKRKPBIFRRYAH-UHFFFAOYSA-N
ID: 41637
SMILES:C12C3C(CC=C1C)C(C)(C)Oc1cc(C)c(cc12)C(C)C3
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 282.427
CB1 binding score: -14.894
InChIKey:LTKWPHZPQJYGMA-UHFFFAOYSA-N
ID: 41638
SMILES:CC1(C)CCCC1(c1c(OC)ccc(CCCCC)c1)CCCC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.61
CB1 binding score: -13.629
InChIKey:CKYZXFWAGBUWHU-UHFFFAOYSA-N
ID: 41639
SMILES:CC1(C)C2CCC(C)=CC2c2c(cc(CCC)c(C(O)=O)c2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.521
InChIKey:IQSYWEWTWDEVNO-UHFFFAOYSA-N
ID: 41640
SMILES:c12c(cc(CCCCC)cc1O)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: 41641
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)CCC21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.071
InChIKey:UGLNUKBERGJBMI-UHFFFAOYSA-N
ID: 41642
SMILES:CC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 41643
SMILES:O1CC(CCC=C(C)C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.335
InChIKey:HOVJPZXDFNWPHY-UHFFFAOYSA-N