ID: 51241
SMILES:C1(OC(=O)C2(N(C)C)CSSC2Cc2ccccc2)C(c2ccccc2)c2c(OC)cc(CCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 563.785
CB1 binding score: -17.81
InChIKey:OLPOKXCWHGXAJD-UHFFFAOYSA-N
ID: 51242
SMILES:CC1(C)C(c2c(O)cc(C(C)(C)CCCCCC)cc2O)CCC1Cl
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.973
CB1 binding score: -15.91
InChIKey:MABRNLJEWQRQKX-UHFFFAOYSA-N
ID: 51243
SMILES:CCC(Oc1c2c(c(O)c(C(C(O)C(C)C)=O)c1)OC(C)(C)C1CCC(C)=CC21)CCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.094
InChIKey:GRUQMGORUDMXES-UHFFFAOYSA-N
ID: 51244
SMILES:C1(C)C2C(O)(c3c(cc(CCCCC)cc3O)OC2)CC(COC)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.277
InChIKey:GOIMACXINLPFKO-UHFFFAOYSA-N
ID: 51245
SMILES:CC(C)C1C=CC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.216
InChIKey:AOOBOQLXJOFYIO-UHFFFAOYSA-N
ID: 51246
SMILES:c1(OC)c(C(CC(C)C)C)cc(O)c2c3c(c(O)c(C(C=C)(C)C)c12)OC(C)(C)C1CC=C(C)CC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -14.801
InChIKey:CNLQMVHMAYRNDF-UHFFFAOYSA-N
ID: 51247
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 51248
SMILES:Cc1cc(O)c2cc1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.632
InChIKey:HLJKZPCVTTYIPT-UHFFFAOYSA-N
ID: 51249
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1c2CC(C)CC1)C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.747
InChIKey:KGWLUJMIANKENP-UHFFFAOYSA-N
ID: 51250
SMILES:C(CC)c1csc2cc(O)c(C3C(C(C)=C)CCC(C)=C3)c(CCCC(C)=CCCC(C)CC(C(C)CC)(C)C)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 576.975
CB1 binding score: -15.354
InChIKey:BELBHJWGUABVLZ-UHFFFAOYSA-N
ID: 51251
SMILES:O(CC1=CC2C(C(C)(C)Oc3ccc(CCCCCC)cc32)CC1)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.929
InChIKey:GZVKQTQHIJEHQX-UHFFFAOYSA-N
ID: 51252
SMILES:CC(C)=CCC1Oc2c(c(O)c(C(=O)O)c(CCCCC)c2)C2C1(C)CCC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -15.963
InChIKey:JNDJQBVSBJWTHK-UHFFFAOYSA-N
ID: 51253
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C3C(CCC(C)(O)C3C2)C(=C)CO1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.816
InChIKey:TVKYPZTTWPLPSG-UHFFFAOYSA-N
ID: 51254
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(CC)C)C3C4(O)C(C)CC4(C(=C)C)C1(O)OC(C)(CC3)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -13.604
InChIKey:YOCYMGAHJFBMKC-UHFFFAOYSA-N
ID: 51255
SMILES:CCCCCc1cc(O)c(CC=C(CCC=C(C)C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.968
InChIKey:RNKSQHRRYNTMIO-UHFFFAOYSA-N
ID: 51256
SMILES:C(C=CC)c1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -17.387
InChIKey:YFXLEYXEROSHSK-UHFFFAOYSA-N
ID: 51257
SMILES:c1(CCCCC)c(-c2ccccc2OC)c(CC=C(CCC=C(C)C)C)c(O)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -16.236
InChIKey:KWPVKWAFGBPXHS-UHFFFAOYSA-N
ID: 51258
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 51259
SMILES:Oc1c2c(cc(CCCCC)c1)C1CC(C)(OC(=O)C1)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.731
InChIKey:IPTFOALWWXKDNI-UHFFFAOYSA-N
ID: 51260
SMILES:c1(C)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 51261
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N