ID: 45403
SMILES:C(CCCc1cc2c(c(O)c1C(O)=O)C=CC(C)(C)O2)C(=O)C(C)=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -14.041
InChIKey:OFRZWHRRXNQMMN-UHFFFAOYSA-N
ID: 45404
SMILES:C(C(O)=O)(CCC=C(C)C)=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -17.36
InChIKey:IYRIVZDSSNIJSN-UHFFFAOYSA-N
ID: 45405
SMILES:C(O)(C1=CC2C(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 45406
SMILES:CC(C)C1(CC=C(C)C)CC2c3c(c(O)cc(CCCCC)c3)C(=O)C(=C2)C(C)(C=CC=C(C)C(OC)=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.737
CB1 binding score: -15.293
InChIKey:XJWRXTPQAMYPBG-UHFFFAOYSA-N
ID: 45407
SMILES:C(C)(C)=CCCC(=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 45408
SMILES:C1(C)=CCC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.792
InChIKey:SJZVNVPYZDSYFZ-UHFFFAOYSA-N
ID: 45409
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C(O)C(C)=CC1=O)C(C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.622
InChIKey:ZMMYBSCMZIDZPH-UHFFFAOYSA-N
ID: 45410
SMILES:C(OC1C(=O)C(C)=CCCC(C)=CCc2c(OC)cc(CCCCC)cc21)(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.309
InChIKey:AKGDZUQYYGJSPT-UHFFFAOYSA-N
ID: 45411
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(CO)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 45412
SMILES:c12cc(CO)c(O)c3c1c(c(OC1C(O)C(O)C(CO)O1)cc2C)OC(C)(C)c1C3C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.561
CB1 binding score: -12.668
InChIKey:KECSQDSKBIVGSY-UHFFFAOYSA-N
ID: 45413
SMILES:C(=CCCC(C=Cc1c(O)c(C2=CC(=O)OC(CO)O2)c2c(c1)OC(C)(C)C1C2C=C(C)CC1)=O)CCCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.692
CB1 binding score: -14.29
InChIKey:OSJSHDOPPLVEMX-UHFFFAOYSA-N
ID: 45414
SMILES:O(c1cc(CCCCC)cc2c1C1C(CC=C(CO)C1)C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -10.274
InChIKey:NXTJXYPXCYITSL-UHFFFAOYSA-N
ID: 45415
SMILES:C1(C)=CC2c3c(cc(C)cc3O)OC3(C)CC(C(OO)=O)(C1)C3C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -14.355
InChIKey:OQBJMXDYZRQTCT-UHFFFAOYSA-N
ID: 45416
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(O)(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 45417
SMILES:C1C2C(C=O)=C(C)CC2C(C)(C)Oc2cc(C)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.946
InChIKey:QCDHFZFCWZSWIK-UHFFFAOYSA-N
ID: 45418
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC1(CO)OC1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -13.177
InChIKey:YGXQLDHUCQHJOC-UHFFFAOYSA-N
ID: 45419
SMILES:Cc1c(CC)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -14.499
InChIKey:IPXBZXQYPVXUTO-UHFFFAOYSA-N
ID: 45420
SMILES:C12C(C)(C)Oc3cc(CO)c(C=O)c(O)c3C1CC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -17.383
InChIKey:XCEUQGIVWFZSLV-UHFFFAOYSA-N
ID: 45421
SMILES:C(C)(=CCCC1(C)CCc2c(C)c(O)c3c(c21)OC(C)(C)C1C3C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -11.302
InChIKey:PVAFDVBWPKUKMM-UHFFFAOYSA-N
ID: 45422
SMILES:COC(=O)C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.562
InChIKey:MYKDUONLLIRERC-UHFFFAOYSA-N
ID: 45423
SMILES:c1(C)c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C(C(O)=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.878
InChIKey:OQJVSVVXOGJSPB-UHFFFAOYSA-N