ID: 68125
SMILES:C1=CCOC2(C(C)C)Oc3c(c(OC)cc(CCCCC)c3)C3C2(C)C3C1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.811
InChIKey:GSAWSKWNXQHJFL-UHFFFAOYSA-N
ID: 68126
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 68127
SMILES:c1c2c(c(C)c(CCCCCC)c1)OC(C)(C)C1CC=C(C(=O)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -15.828
InChIKey:IMGUKNHPIKRUKN-UHFFFAOYSA-N
ID: 68128
SMILES:C(=C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC(OC)=O)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.399
InChIKey:XCRUIMJFPZDGOC-UHFFFAOYSA-N
ID: 68129
SMILES:Oc1c(CC(CCC=C(C)C)=C)cc(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.67
InChIKey:DGVMACKIWSOJLW-UHFFFAOYSA-N
ID: 68130
SMILES:C(CC1(C)Oc2c(c(OC)cc(O)c2)C=C1)=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.259
InChIKey:AAUBCOTTZLIMOU-UHFFFAOYSA-N
ID: 68131
SMILES:CC(=CCC1C(C=O)(C)C(C(=O)CC(C)C)c2cc(O)c3c(c21)OC(C)(C)C1C3C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -15.296
InChIKey:WDINQXXWIGHKIA-UHFFFAOYSA-N
ID: 68132
SMILES:C1(C)C(C)=C2C(C(O)C1)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.116
InChIKey:VQBYBWWKCPGGKS-UHFFFAOYSA-N
ID: 68133
SMILES:c1(C)c(CCC)cc2c(c1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.383
InChIKey:VAKHONOQMQUWQY-UHFFFAOYSA-N
ID: 68134
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1=C2CC(O)(C)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.075
InChIKey:JXUYBQUFQSWLKX-UHFFFAOYSA-N
ID: 68135
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 68136
SMILES:C1=C(C)CCC2C(C)(C)Oc3ccccc3C(O)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -16.282
InChIKey:SHPNZILVORBTIY-UHFFFAOYSA-N
ID: 68137
SMILES:C1C(Cc2c(CO)cc(O)c3c2OC(C)(C)C=C3)=C(C)CC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.775
InChIKey:BKZCPTQHPKWXNT-UHFFFAOYSA-N
ID: 68138
SMILES:C(C1=C(C)C2C(C1)C(C)(C)Oc1cc(C)ccc12)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -15.434
InChIKey:JJKLQWQJRQNATA-UHFFFAOYSA-N
ID: 68139
SMILES:O=C1c2cc(CCCCC)ccc2OC(C)(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.769
InChIKey:WRUXJMUVIJLAJG-UHFFFAOYSA-N
ID: 68140
SMILES:CC(CC(O)C=C(C)C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.677
InChIKey:FYUMLDZFQYVKKK-UHFFFAOYSA-N
ID: 68141
SMILES:CC(=CCCC1(C)CCc2c(oc3cc(CCCCC)cc(O)c3O2)cc1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.53
InChIKey:DZBGNNPUJHYARO-UHFFFAOYSA-N
ID: 68142
SMILES:C1CCC2(C)C3C(C(C)(O)c4occ(C)c4C(O)C34C(=C1)O2)Oc1ccc(CCCCC)cc1O4
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.601
CB1 binding score: -14.964
InChIKey:GRJWFTSCPPDCHB-UHFFFAOYSA-N
ID: 68143
SMILES:O=C(C)Oc1c2c(cc(CCCCC)c1)OC1(C)CC=C(C(C)CCC=C(C)C)C1CC2OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -15.244
InChIKey:UQOFMDAKNFOXKK-UHFFFAOYSA-N
ID: 68144
SMILES:C1(C(C)C)C(c2c(O)cc(OC)cc2)OC(C=CC2=CC(CC(C)=CCc3cc(OC)cc(C)c3O)=O)CCC2(C)Oc2c1c(O)cc(CCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 724.935
CB1 binding score: -14.663
InChIKey:IZBGPKZXWQVINF-UHFFFAOYSA-N
ID: 68145
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CCC(O)C(C)=C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.015
InChIKey:OTWCOVLBFOXUIA-UHFFFAOYSA-N