ID: 127009
SMILES:c1(N2C(=O)C(CCCC)C(=O)OC2)cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 467.65
CB1 binding score: -14.605
InChIKey:IWHJOEQPAPOLGH-UHFFFAOYSA-N
ID: 127010
SMILES:Oc1c(O)c(C2C=C(C)CCC2C(C)=C)c(O)cc1CC=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.633
InChIKey:OERHMRYJWFBCQB-UHFFFAOYSA-N
ID: 127011
SMILES:CC1(C)Oc2ccc(CO)c(O)c2C2(C)C=CCC(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.807
InChIKey:RDRQMIAGQPICGS-UHFFFAOYSA-N
ID: 127012
SMILES:C1C(O)(C)C(O)C(c2c(O)cc(CCCCC)cc2OC)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.688
InChIKey:IKEWUXCAXLXBNU-UHFFFAOYSA-N
ID: 127013
SMILES:C(CC)CCC(c1c(C)c(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -17.089
InChIKey:HHIIPINVKRPNBY-UHFFFAOYSA-N
ID: 127014
SMILES:C1(C)=CC(c2c(O)cc(CCC)cc2O)C(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -16.761
InChIKey:QVLZLJKWXYLKLV-UHFFFAOYSA-N
ID: 127015
SMILES:CC12CC(c3c(O)cc(CCCCC)cc3OC1=O)C(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.438
InChIKey:AGYBLTAICHTPSH-UHFFFAOYSA-N
ID: 127016
SMILES:CC(=CCc1c(OC)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -18.913
InChIKey:GDBWRAFIFHBEOL-UHFFFAOYSA-N
ID: 127017
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.797
InChIKey:KERKCYZDMNZUKU-UHFFFAOYSA-N
ID: 127018
SMILES:C12(O)Cc3c(O)cc(CCCCC)cc3OC1(C)C(=O)CC(C(C)=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.078
InChIKey:HNBQYLVKLDZLEC-UHFFFAOYSA-N
ID: 127019
SMILES:C(c1c(O)c2c3c(c1)OC(C)(C)C1CCC(C)(O3)C21)CCCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.083
InChIKey:HKVGWAONCXTRNS-UHFFFAOYSA-N
ID: 127020
SMILES:O=C(C=C(C)C)c1c(O)c(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -15.018
InChIKey:QLPYARRYSNXDLX-UHFFFAOYSA-N
ID: 127021
SMILES:CC(C1C(c2c(O)cc(CCC)cc2O)C=C(C)C(O)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.77
InChIKey:LAXJVOZUDHUTET-UHFFFAOYSA-N
ID: 127022
SMILES:C1(C)(C)C2CC=C(C(O)=O)CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.482
InChIKey:LUVSRWROAAHJJR-UHFFFAOYSA-N
ID: 127023
SMILES:C(c1ccccc1)(C)c1c(O)cc(CCCCC)cc1OC1(C)CCC=C(C)CCC(C(C)=C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.74
CB1 binding score: -16.192
InChIKey:WYJVMJAUYDAPAS-UHFFFAOYSA-N
ID: 127024
SMILES:CC1(O)C=CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 127025
SMILES:c1(O)cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127026
SMILES:C1(C(C)=C)C(c2c(O)ccc(O)c2CC=C(C)C)C=C(COC)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.749
InChIKey:WTCRHTONXKYLMD-UHFFFAOYSA-N
ID: 127027
SMILES:C(O)(CO)C(C(O)C(OCC(=C)C1CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1)=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.636
CB1 binding score: -12.245
InChIKey:AAAUZRLIJSROBS-UHFFFAOYSA-N
ID: 127028
SMILES:C=C1C2C(c3c(O)cc(CCCCC)cc3OC2=O)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.768
InChIKey:AZIUSKYNLAJADP-UHFFFAOYSA-N
ID: 127029
SMILES:C(C(C)=CCc1c(O)cc(CCC)cc1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N