ID: 98596
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 98597
SMILES:Oc1cc(CCC)cc2c1C1OC(C)(C)C3CCC(C)(O3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.217
InChIKey:HWWCONZMSJZQOV-UHFFFAOYSA-N
ID: 98598
SMILES:C(CC)CCCc1c(O)cc2c(c1O)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.049
InChIKey:VBEZFGHMUAVXDS-UHFFFAOYSA-N
ID: 98599
SMILES:C1(=O)CCC2(C)c3c(O)cc(CCCCC)c(O)c3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -16.538
InChIKey:JPYWIXNZTNWARN-UHFFFAOYSA-N
ID: 98600
SMILES:C12(C)C3C(c4c(cc(CCCCC)cc4)OC3CC(C)=CC(=O)C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.259
InChIKey:PVZYTSUQPOUCJQ-UHFFFAOYSA-N
ID: 98601
SMILES:C(CC)Cc1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -19.327
InChIKey:GGVVJZIANMUEJO-UHFFFAOYSA-N
ID: 98602
SMILES:C(c1c(O)c2c(cc1C)OC(C)(C)C1=C(CC1C)CC2=O)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.628
InChIKey:XORJBVUJROARAV-UHFFFAOYSA-N
ID: 98603
SMILES:C1(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.293
InChIKey:VAHUUHMSLIHMFN-UHFFFAOYSA-N
ID: 98604
SMILES:CC(C)C(=O)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(COC(C)=O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -16.765
InChIKey:NVSMCITYVSGUHG-UHFFFAOYSA-N
ID: 98605
SMILES:C(C(C)=CC)(OC(CC)c1c(OC)c(C(CC(C)C)=O)c(O)c2c1OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.66
CB1 binding score: -16.879
InChIKey:IJKZMQDASNYILQ-UHFFFAOYSA-N
ID: 98606
SMILES:C1C(C)=CCC2C(C)(C)Oc3c(c(C)c(O)c(C(OC)=O)c3C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.273
InChIKey:UYZVBVKPPACODZ-UHFFFAOYSA-N
ID: 98607
SMILES:c1(O)c(CC=C(CC(C=C(C)CCC=C(C)C)O)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.603
CB1 binding score: -18.107
InChIKey:FMOIMMFSJNNXQB-UHFFFAOYSA-N
ID: 98608
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(=O)CCC(C)C)c(O)cc(O)c32)CC=C(C)CCC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -16.904
InChIKey:LMTAKYYALOBYOI-UHFFFAOYSA-N
ID: 98609
SMILES:O=C1CC2c3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.306
CB1 binding score: -16.067
InChIKey:MWYBAWSVCWUPRT-UHFFFAOYSA-N
ID: 98610
SMILES:OC1C(C)=CC2C(C(C)(C)Oc3cc(CCc4ccccc4)c(OC)c(C=O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.522
CB1 binding score: -16.706
InChIKey:DYAARVNBJLXQBT-UHFFFAOYSA-N
ID: 98611
SMILES:C1(=O)C2CCOC2OC2C3C1c1c(cc(CCCCC)cc1O)OC(C)(C)C3CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -14.807
InChIKey:ZEGFUEUOCXGATO-UHFFFAOYSA-N
ID: 98612
SMILES:C(COC(=O)CCCCCCCCC)CCc1cc2c(c(O)c1)C1C(CC2)C(C)(C)Oc2cc(O)cc(OC3C(O)C(O)C(O)C(COC)O3)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 714.893
CB1 binding score: -15.293
InChIKey:QOOVZJBVUIQQKO-UHFFFAOYSA-N
ID: 98613
SMILES:C12C(C)(CCC(C(C)(C)OC(=O)C)O)Oc3c(c(OC(=O)C(C)C)c(OC(C)=O)c(CC=C(C)C)c3)C1CC=C(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.75
CB1 binding score: -15.042
InChIKey:LIJSXPYGUOVDKE-UHFFFAOYSA-N
ID: 98614
SMILES:C(Cc1cc2c(c(OS(=O)(=O)O)c1)C1C(C)=CCC1C(C)(C)O2)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 378.49
CB1 binding score: -14.719
InChIKey:ZWEATZQGLYVRSO-UHFFFAOYSA-N
ID: 98615
SMILES:C12C3C(C)(OC1)Oc1c(c(O)cc(CCC)c1)C3C(C(=CC)C)C(=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.11
InChIKey:OFDWUROXIKGFCH-UHFFFAOYSA-N
ID: 98616
SMILES:C1(C)(C)C2C3(C(O3)CC1)Cc1c(O)cc(CCCCC)c(C(=O)O)c1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.25
InChIKey:NTAPEFHADXLXLJ-UHFFFAOYSA-N