ID: 2101
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 2102
SMILES:C(=C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)c(Cl)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.914
CB1 binding score: -16.382
InChIKey:MIAHOZITLDYHKB-UHFFFAOYSA-N
ID: 2103
SMILES:CC1=CCCC(C)(O)C2OC(CC1)C(C)(C)Oc1cc(O)c(C=O)c(CCCCC)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -15.231
InChIKey:LEKOIATVDDKSAC-UHFFFAOYSA-N
ID: 2104
SMILES:c1cc(O)c2c(c1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.367
InChIKey:ARCCJNTVTZPGNU-UHFFFAOYSA-N
ID: 2105
SMILES:c12cc(ccc1)Oc1c(c3c(cc1O)OC(C)(C)C3CC=C(C)C)OC(C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.538
CB1 binding score: -12.431
InChIKey:ZTJYRYZACKZHIR-UHFFFAOYSA-N
ID: 2106
SMILES:C12CC(CO)(C)CC1C(=O)C1C(c3c(cc(CCCCC)cc3O)O1)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.041
InChIKey:BRGVDSRKKOPPRZ-UHFFFAOYSA-N
ID: 2107
SMILES:C12C(C)(CC(O)CC1(C)C)Oc1c(c(O)cc(CCCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.467
InChIKey:BEVGILVVJSIKDU-UHFFFAOYSA-N
ID: 2108
SMILES:C=C(C1CC=C(C)CC1c1c(O)cc(O)cc1CCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.133
InChIKey:DMZFIVFXJMHHOS-UHFFFAOYSA-N
ID: 2109
SMILES:CC(C)=CCCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 2110
SMILES:C=C(Cc1c(O)c2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1CC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.374
InChIKey:LKMYHIJTPGYQOT-UHFFFAOYSA-N
ID: 2111
SMILES:Oc1cc(CC=C(CCC=C(C)C)C)c(O)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 2112
SMILES:c1(CCCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(OC)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.15
InChIKey:YBAIIWFAXUJWTP-UHFFFAOYSA-N
ID: 2113
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 2114
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 2115
SMILES:c1(CC(C)C)cc(O)c2c(c1)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.681
InChIKey:VNGWBDGGUCOXTA-UHFFFAOYSA-N
ID: 2116
SMILES:C1(Cc2c(O)cc(CCCCC)cc2O)=C(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.502
InChIKey:BXSAWMQNDRARAR-UHFFFAOYSA-N
ID: 2117
SMILES:c1(O)c(O)c2c(cc1)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -15.555
InChIKey:LJMUVVWXPVVTJM-UHFFFAOYSA-N
ID: 2118
SMILES:CC1=CC2c3c(O)cc(CCCCC)c(C(O)=O)c3OC(C)(C)C2CC1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.629
InChIKey:WLPSNWGGKMITGU-UHFFFAOYSA-N
ID: 2119
SMILES:c1(C=O)c2c(c(O)cc1C)C(C)(C)Oc1cc(CCCCC)c(C(=O)O)c(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.482
CB1 binding score: -19.492
InChIKey:MPWHBKZHNDPBJD-UHFFFAOYSA-N
ID: 2120
SMILES:c12c(I)c(O)c(C(=O)CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.375
CB1 binding score: -16.861
InChIKey:QSYDEHQYHVKMJN-UHFFFAOYSA-N
ID: 2121
SMILES:C1(C)(C)Cc2c(c(O)c(C(C(C)C)=O)c(O)c2)-c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -13.797
InChIKey:RVLWSFFUKUPXCJ-UHFFFAOYSA-N