ID: 90133
SMILES:C(CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(=C)C(O)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.477
InChIKey:XFZYRBXIYBUZFO-UHFFFAOYSA-N
ID: 90134
SMILES:c1(O)c2c(cc(CCCC)c1)OC(C)(C)C1=C2C(=O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.694
InChIKey:HSSGGUKIARBDPN-UHFFFAOYSA-N
ID: 90135
SMILES:c1(NCCc2ccccc2)cc(CCCCC)cc2c1OC1(C(C)(O2)C(C)=C)C2C(C(C)C)CCC(C)=C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 541.82
CB1 binding score: -15.873
InChIKey:VPFUOXVUZHWLPU-UHFFFAOYSA-N
ID: 90136
SMILES:C(CCCC)CCc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -17.334
InChIKey:UPDGTGSMFWHMQH-UHFFFAOYSA-N
ID: 90137
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.593
CB1 binding score: -16.045
InChIKey:IEJDLTWSCOMFKC-UHFFFAOYSA-N
ID: 90138
SMILES:C1(O)Oc2cc(CCCCC)cc3c2C1C(C)CC3C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.34
InChIKey:KKXWZSNWKDMBIR-UHFFFAOYSA-N
ID: 90139
SMILES:C(=CCCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.73
InChIKey:FIPBXVBQTMSTCS-UHFFFAOYSA-N
ID: 90140
SMILES:OC(=O)c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2C=C(C(=O)OC)C(OC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 460.523
CB1 binding score: -14.377
InChIKey:DEBQXUMGPUCBKT-UHFFFAOYSA-N
ID: 90141
SMILES:CC1=CC(c2c(O)cc(C(C(CCCCC)C)C=C(C)C)cc2O)OC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.395
InChIKey:SDFYCYOGJFTCRF-UHFFFAOYSA-N
ID: 90142
SMILES:C1(C)=CC2c3c(cc(C)cc3OC)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.284
InChIKey:PTEGQFOMOTXOIF-UHFFFAOYSA-N
ID: 90143
SMILES:C1C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCC)c31)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.636
InChIKey:PZJOEBXMTULDLX-UHFFFAOYSA-N
ID: 90144
SMILES:CC1(C)C2C(c3c(O)cc(CCC)cc3O)C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.214
InChIKey:KADTXVVJUJVZRF-UHFFFAOYSA-N
ID: 90145
SMILES:C1(C(O)CC=C(C)C)(C)Oc2cc(CCCCC)cc(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.988
InChIKey:RQPBTFMAKYMDGK-UHFFFAOYSA-N
ID: 90146
SMILES:C1C2C=C(C1)C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -12.951
InChIKey:DEOGJZVJFXMTML-UHFFFAOYSA-N
ID: 90147
SMILES:C1(O)C(O)C(CO)OC(Oc2c(CC=C(CCC=C(C)C)C)c(CCCC)ccc2)1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.574
CB1 binding score: -16.035
InChIKey:YKAVBMIPWSIBGF-UHFFFAOYSA-N
ID: 90148
SMILES:CC(=C)C1CCC2C(C)(C1C)CC=C1C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -13.106
InChIKey:UDDBATBEEKMFDX-UHFFFAOYSA-N
ID: 90149
SMILES:O=Cc1cc2c(cc1)C(C)(COc1cc(CCCCC)ccc1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -14.886
InChIKey:OQCUDRPZBZOFFU-UHFFFAOYSA-N
ID: 90150
SMILES:C1CC(C)C2C(c3c(O)cc(CCCC)cc3O2)C1C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.942
InChIKey:ASXYMQFDHBSTLT-UHFFFAOYSA-N
ID: 90151
SMILES:c12c(O)c(C(COC(C)=O)CO)c(OC(CC(C)C)=O)c(O)c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.566
CB1 binding score: -16.502
InChIKey:ALKWSERRCNOPOY-UHFFFAOYSA-N
ID: 90152
SMILES:C1(=O)C2C(C(O)=O)=CC3C(C)(C)OC13c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.417
CB1 binding score: -14.422
InChIKey:VZMKOEURUAZDFB-UHFFFAOYSA-N
ID: 90153
SMILES:c12c3c(cc(O)c1CC(=O)O2)OC(C)(C)C1C3CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.354
CB1 binding score: -15.206
InChIKey:UWPMHKHMNDUUKI-UHFFFAOYSA-N