ID: 91162
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C(O)(C)C)(O)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.391
CB1 binding score: -17.014
InChIKey:ODDYYDUWLVFCOM-UHFFFAOYSA-N
ID: 91163
SMILES:Oc1c(C(=O)C)c(CCCC)cc(O)c1CC=C(C)CCC=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 412.614
CB1 binding score: -15.374
InChIKey:IJLXQAWUXUTSHL-UHFFFAOYSA-N
ID: 91164
SMILES:C(C1CC=C(C)CC1c1c(O)cc(CCCCC)cc1O)(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.129
InChIKey:ZTGXAWYVTLUPDT-UHFFFAOYSA-N
ID: 91165
SMILES:c1c(CCCCC)c(O)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.442
InChIKey:PMGCHKYNYZMWIY-UHFFFAOYSA-N
ID: 91166
SMILES:C1CC(C)=CCCC2(C)Oc3cc(CCC)cc(O)c3C2C2(OC(=O)C(C)=C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -12.504
InChIKey:IWSLIDAGWJSBCK-UHFFFAOYSA-N
ID: 91167
SMILES:C12CCC(O)(C)C(O)CC1C(C)(C)Oc1cc(CCCCC)c(C(=O)OC)c(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -15.193
InChIKey:FSSHRCTXIYMEJO-UHFFFAOYSA-N
ID: 91168
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(CO)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 91169
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C2C(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.302
InChIKey:GYADAKWPNOPPAL-UHFFFAOYSA-N
ID: 91170
SMILES:CC(=C)C1C(c2c(O)cc(CCC)cc2O)C(C)CC1C(=O)Oc1ccc(Br)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 473.407
CB1 binding score: -14.067
InChIKey:FXCZNVYNRMAHNV-UHFFFAOYSA-N
ID: 91171
SMILES:C1CC(O)C2C13c1c(cc(CCCCC)cc1O2)OC3(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.389
InChIKey:DEHVKORBBFFGAP-UHFFFAOYSA-N
ID: 91172
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C1(C)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.528
InChIKey:RUNFDTKOHGWARR-UHFFFAOYSA-N
ID: 91173
SMILES:C(=O)(C(C1=C(C)C(C)(C(C)=C)Oc2cc(CCCCC)cc(O)c21)O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.724
InChIKey:DLNFXERMFYJRER-UHFFFAOYSA-N
ID: 91174
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 91175
SMILES:c1c(C(O)C=CC23CC(C(C)=C)C(c4c(O)cc(CCCCC)cc4O2)O3)cccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.549
CB1 binding score: -15.552
InChIKey:UMAYIUFGPNXNRS-UHFFFAOYSA-N
ID: 91176
SMILES:c1(O)cc(CC=C(CCC=C(C)C)C)c(O)cc1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.051
InChIKey:TXLIVWXFPYVBTA-UHFFFAOYSA-N
ID: 91177
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.69
InChIKey:MPYDMCXDBHAPAA-UHFFFAOYSA-N
ID: 91178
SMILES:C(c1c(CCCCC)cc(O)c2c1OC(C)(C)C1CCC(C(=O)O)=CC21)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.037
InChIKey:XUOQBXYPEUXLQV-UHFFFAOYSA-N
ID: 91179
SMILES:C12C(c3c(O)cc(CCCCC)cc3OC1(C)C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 91180
SMILES:OC(C)(C)C1C2(C(=O)C(C)=CC1=O)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.442
InChIKey:ZVDPJIXIGMVHHV-UHFFFAOYSA-N
ID: 91181
SMILES:Oc1cc(CCC)cc2c1C13C(CC(C)(O)C(O)C1O2)C=CC(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.465
InChIKey:OCFZJDWKQCKCIF-UHFFFAOYSA-N
ID: 91182
SMILES:c1(C(C(OC(=O)C)C(CC(C)C)C)C)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.229
InChIKey:MCWFJNMPYWIMRW-UHFFFAOYSA-N