ID: 67957
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)c(C(=O)OC(C)=O)c3O)OC(C)(C)C2CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.634
CB1 binding score: -15.159
InChIKey:FKYDDGKDCBXMIF-UHFFFAOYSA-N
ID: 67958
SMILES:C1C(C2=C(C(C)CC)C=CC(C)(C)O2)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -15.734
InChIKey:JYFKEKBFASRKPA-UHFFFAOYSA-N
ID: 67959
SMILES:C12C(C)(Oc3c(c(O)cc(CCCCC)c3)C1O)CCC1C(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.221
InChIKey:RANGLOXFSNUYEM-UHFFFAOYSA-N
ID: 67960
SMILES:C(OC(C)=O)Cc1cc(CCCCC)cc2c1OC(C)(C)C1OC(C)(CC1)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.82
InChIKey:WDUISBBIEDVNOG-UHFFFAOYSA-N
ID: 67961
SMILES:CC1(C)CC2c3c(cc(C)c(C(=O)O)c3O)OC(C)(C)C2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -16.583
InChIKey:HIAQLMQUDGATBP-UHFFFAOYSA-N
ID: 67962
SMILES:C(C(C)=CC)(=O)OC1C(C)C2(C)C3(C(O3)(c3c(cc(CCCCC)cc3O)O2)C=C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.58
CB1 binding score: -13.39
InChIKey:QKQRHLPLVGELHU-UHFFFAOYSA-N
ID: 67963
SMILES:C1CC(C(C)C)C(c2c(O)cc(CCC)cc2O)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.447
CB1 binding score: -19.319
InChIKey:VNFNICPIQJPBJY-UHFFFAOYSA-N
ID: 67964
SMILES:c1(CCCCC)c(O)cc(O)c2c1OC(CCC=C(C)C)(C)CC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.162
InChIKey:YQNKUDNOZACOAB-UHFFFAOYSA-N
ID: 67965
SMILES:CC1(C)Oc2c(c(O)cc(CCCC)c2)C2C1CC(O)C(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.962
InChIKey:MVBUZUVPKJXXNR-UHFFFAOYSA-N
ID: 67966
SMILES:c1(O)cc(O)c2c(c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.624
InChIKey:ZZWZWPVQXHMOQM-UHFFFAOYSA-N
ID: 67967
SMILES:O=C(C=C(C)C)OC1C(O)C(C)C(=O)c2c(cc3c(c2O)OC(C)(C)C2CCC(C)=CC23)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.617
CB1 binding score: -16.237
InChIKey:SLWVUGQWTFZZAI-UHFFFAOYSA-N
ID: 67968
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 67969
SMILES:C1C(C)CC2c3c(O)cc(C)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 67970
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C(CO)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.401
InChIKey:IQFBDTWPFXQKNC-UHFFFAOYSA-N
ID: 67971
SMILES:c12c(c(O)cc(CCCCC)c1)C(=O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 67972
SMILES:Cc1c(=O)c(O)cc2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.094
InChIKey:PYCZZUOXJLPIBU-UHFFFAOYSA-N
ID: 67973
SMILES:C1C2C3C(c4c(cc(CCC)cc4O)OC3(C)C1)C(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.348
InChIKey:DCHVMZGDJUJRQQ-UHFFFAOYSA-N
ID: 67974
SMILES:c1(CCCC)cc2c(c(O)c1)C1CC(C)C(=O)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -18.352
InChIKey:GSBDFCQZOYLNRC-UHFFFAOYSA-N
ID: 67975
SMILES:C1CCC=C(C)C2C1(C)C(OC)c1c(CCCCC)cc(OC(=O)C)c(OC(C)=O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.117
InChIKey:YOFZDRLDWQUMPJ-UHFFFAOYSA-N
ID: 67976
SMILES:OC(C1Cc2ccccc2OC1(C)C)CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 234.339
CB1 binding score: -15.763
InChIKey:STQYOVZFPGHDHQ-UHFFFAOYSA-N
ID: 67977
SMILES:C1C=C(C)CC(c2c(O)cc(C)cc2O)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.279
CB1 binding score: -15.636
InChIKey:XABKCLWUMXGKKI-UHFFFAOYSA-N