ID: 76252
SMILES:c1(C2C(C(C)=C)CC(O)C(CO)=C2)c(O)cc(CCCCC)c(Br)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.364
CB1 binding score: -16.379
InChIKey:GDFJMYCTXMINNB-UHFFFAOYSA-N
ID: 76253
SMILES:C1(C)=CC2c3c(cc(CCCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 76254
SMILES:C1(C)(C)CC2(C)C(=CC3=C(C(=O)C(CCCCC)=C3C)O2)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.843
InChIKey:FZULULVHGRHAAO-UHFFFAOYSA-N
ID: 76255
SMILES:C1C2=C(CCC(O)C2(C)C)c2c(cc(CCCCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.031
InChIKey:FHOAOZVGZPYTMS-UHFFFAOYSA-N
ID: 76256
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCc2c1oc(=O)c(CC=C(C)C)c2)C(=CC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.684
CB1 binding score: -12.51
InChIKey:RXYVWRJCPPLYLT-UHFFFAOYSA-N
ID: 76257
SMILES:C(CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C=O)C1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.04
InChIKey:NKVQXIJXCXVNJQ-UHFFFAOYSA-N
ID: 76258
SMILES:c1(CCCCC)cc(O)c2cc1c1c2C(O)(CC(C)C)OC(C)(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.547
InChIKey:WJDRPZWAZOJNTQ-UHFFFAOYSA-N
ID: 76259
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(COC(=O)C=CC)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -16.229
InChIKey:DDYYBKQYQOXZFX-UHFFFAOYSA-N
ID: 76260
SMILES:Oc1c(C(=O)CC(C)C)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.385
InChIKey:KCKFCLWTUCSIQS-UHFFFAOYSA-N
ID: 76261
SMILES:CC1(C)C2CC=C(C)CC2c2c(ccc(C)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.666
InChIKey:UYYGZUNBFWROKO-UHFFFAOYSA-N
ID: 76262
SMILES:C1C2C(C)(C(C)C(OC(C)=O)CC2)C2c3c(O)cc(CCCCC)cc3OC(C1)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.64
CB1 binding score: -15.436
InChIKey:VISQIRKONMAUMM-UHFFFAOYSA-N
ID: 76263
SMILES:C(C)C(C(c1c2c(cc(O)c(C(CC)O)c2)c2c(c1)OC1(C)CCC3C1C2C3(C)C)O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.635
CB1 binding score: -15.526
InChIKey:JCIKEUUZJHQNOV-UHFFFAOYSA-N
ID: 76264
SMILES:C1(C)CCC2C(C)(C)Oc3c(c(OC)c(C(C)C(C(C)CC)OC(C)=O)c(O)c3O)C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.627
CB1 binding score: -14.982
InChIKey:MZJGYPITHNPDEM-UHFFFAOYSA-N
ID: 76265
SMILES:C(C)CCCc1c(-c2cc(CCCCC)cc(O)c2)cc(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 478.717
CB1 binding score: -15.297
InChIKey:HCGLRRBVNMLUIA-UHFFFAOYSA-N
ID: 76266
SMILES:C1(O)C(Oc2c(CC=C(C)C)c(O)cc(CCCCC)c2)OC(CO)C(O)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.507
CB1 binding score: -17.229
InChIKey:DEJBVDPQQDKBBA-UHFFFAOYSA-N
ID: 76267
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 76268
SMILES:O1c2c(c(O)cc(CCC)c2)C2C=C(CC=C)CCC2(OC)C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.556
InChIKey:HYVCANPWBHRFFU-UHFFFAOYSA-N
ID: 76269
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C(O)=O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 76270
SMILES:CC1(O)C2C(CC1)C(C)(C)Oc1cc(O)cc(CCCCC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.259
InChIKey:ADJUGSFXFHNJHM-UHFFFAOYSA-N
ID: 76271
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1c2cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -18.878
InChIKey:GUXGXKFPIHIMLU-UHFFFAOYSA-N
ID: 76272
SMILES:c1(CCCCC)cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N