ID: 56218
SMILES:CC(CO)(C1CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C2C1=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -16.425
InChIKey:MPGKAHJDAILGEI-UHFFFAOYSA-N
ID: 56219
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2OC1(C)CCC1C(C)(CCC1O)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -16.1
InChIKey:GJLOAZPQRLEAET-UHFFFAOYSA-N
ID: 56220
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)OC(CC)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.907
InChIKey:TXNWNVMNNDXQHV-UHFFFAOYSA-N
ID: 56221
SMILES:C(CC)(=CCCC(C)=CCc1cc(OC)cc(C)c1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -16.998
InChIKey:JOEMTWREQIGCCT-UHFFFAOYSA-N
ID: 56222
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: 56223
SMILES:C(C)CCCCCCCCCCCCCc1cc(O)c(C2C(C(O)(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.754
CB1 binding score: -12.231
InChIKey:BCPUJCAUOHGCII-UHFFFAOYSA-N
ID: 56224
SMILES:C(c1c(C)c(O)c(O)c2c1c(O)c1c(c2O)OC(C)(C)C2C1C=C(C)CC2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -15.774
InChIKey:FDUNXEPBGMYYBB-UHFFFAOYSA-N
ID: 56225
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C(OC(C)=O)CCC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.929
InChIKey:FMGQDHHGAILOIJ-UHFFFAOYSA-N
ID: 56226
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -19.258
InChIKey:DYHMKBLKWFFFSZ-UHFFFAOYSA-N
ID: 56227
SMILES:c1(O)cc(CCCCC)c(C(=O)O)c(O)c1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 56228
SMILES:C(O)C1(C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -17.481
InChIKey:RUCJJYDBJAIWNY-UHFFFAOYSA-N
ID: 56229
SMILES:c1(CC=C(C)CCC=C(C)C)cc(CCc2cc(O)c3c(c2)OC(C)(C)C=C3)ccc1O
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.604
CB1 binding score: -15.542
InChIKey:FFTXAKJDSCEURF-UHFFFAOYSA-N
ID: 56230
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(C(C)C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.251
InChIKey:GIVNWDNDDALTHM-UHFFFAOYSA-N
ID: 56231
SMILES:C(CN)c1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c2c1cccc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.464
CB1 binding score: -15.397
InChIKey:STESJQYCJLHBCV-UHFFFAOYSA-N
ID: 56232
SMILES:c12c(cc(CCCCC)cc1O)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: 56233
SMILES:C1(=O)CC2C3(C)C(CC4=C(COC5C(O)C(O)C(O)C(CO)O5)C12C(=O)O4)-c1c(O)cc(CCCCC)cc1O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 560.596
CB1 binding score: -14.308
InChIKey:UTXLQOUDSUMUKL-UHFFFAOYSA-N
ID: 56234
SMILES:c1(OC)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.06
InChIKey:KSDSETBZUIJIFF-UHFFFAOYSA-N
ID: 56235
SMILES:C(CCCC)c1cc(O)c2c(c1O)OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.334
InChIKey:AGCCFGXZUUPBIN-UHFFFAOYSA-N
ID: 56236
SMILES:C(C=C(C)C)CC(O)(C)C=CCC1(C)Oc2cc(O)cc(O)c2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.807
InChIKey:KNJOBIPSROXOIX-UHFFFAOYSA-N
ID: 56237
SMILES:CC(C)=CCC1=C(CCCCC)C(=O)C2(C(CO)=CCC(O)C2C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -11.461
InChIKey:GVDVVQBFPLECHN-UHFFFAOYSA-N
ID: 56238
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCCO)cc2O)C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.212
InChIKey:ORZZTKPUOMYUDO-UHFFFAOYSA-N