ID: 61825
SMILES:C(CCCC)C(=O)c1c(C)cc2c(c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -11.14
InChIKey:CBIJPZQYVYLTFQ-UHFFFAOYSA-N
ID: 61826
SMILES:O(c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -15.369
InChIKey:FFITXGTXKZULBQ-UHFFFAOYSA-N
ID: 61827
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)O1)C(C(C)C)CCC2=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.903
InChIKey:CXJSVCDDLHAQCS-UHFFFAOYSA-N
ID: 61828
SMILES:CC1OC(=O)C(c2c(O)ccc(CC[N+](C)(CC=O)CC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.409
CB1 binding score: -15.21
InChIKey:CMPDMPQHPLNKNF-UHFFFAOYSA-O
ID: 61829
SMILES:C1(C(=C)C)C2c3c(O)cc(CCCCC)cc3OC(C)(CO1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.85
InChIKey:VDXZBNPCWOJBSO-UHFFFAOYSA-N
ID: 61830
SMILES:c1(O)c(O)c(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.286
InChIKey:NHNAENUOFBTILX-UHFFFAOYSA-N
ID: 61831
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 61832
SMILES:C(CCC(C)=O)(C)=CCCC1(C)Oc2c(C)cc(OC)cc2C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.151
InChIKey:KPPUWYGOFWEHFK-UHFFFAOYSA-N
ID: 61833
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)c1c-2cc(OC)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -14.83
InChIKey:FMWAGCXEHDKJDP-UHFFFAOYSA-N
ID: 61834
SMILES:O1c2c(c(O)cc(CCCCC)c2O)C2C1(C)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.302
InChIKey:NKTVSCMOLIWBNU-UHFFFAOYSA-N
ID: 61835
SMILES:C=C(C1CC2(O)CCC3=C(C(c4c(O)cc(CCCCC)cc4O)O3)CC1C2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.944
InChIKey:HGLINPYKRBTJES-UHFFFAOYSA-N
ID: 61836
SMILES:CC(C)(OC(C)=O)c1cc2cc(O)c(C3C=C(C)CCC3C(C)=C)c(O)c2o1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -13.806
InChIKey:BPAPCMHUQHGAEJ-UHFFFAOYSA-N
ID: 61837
SMILES:CCCCc1c(C(=O)O)c(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.815
InChIKey:CSQBJQGFPBRFCB-UHFFFAOYSA-N
ID: 61838
SMILES:CC(OOc1cc(CC=C(CCC=C(C)C)C)c(O)cc1CCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.21
InChIKey:GLSUVFNTDYXAGX-UHFFFAOYSA-N
ID: 61839
SMILES:C1Oc2cc(CCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 178.231
CB1 binding score: -15.539
InChIKey:UYARAQQQNQUGGI-UHFFFAOYSA-N
ID: 61840
SMILES:Oc1c2c(cc(CCCCC)c1)OC(CCC=C(CC(C)(O)C)C1=C(O)C(=O)C(C)=CO1)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -12.563
InChIKey:GBYCEFNLBBNORY-UHFFFAOYSA-N
ID: 61841
SMILES:c1c(O)c2c(cc1)OC(C)(C)C1C2C=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.359
InChIKey:KPHBCZKDKSYVRU-UHFFFAOYSA-N
ID: 61842
SMILES:O[N+](=O)CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.49
CB1 binding score: -14.194
InChIKey:BQCKLRJGOWJPSV-UHFFFAOYSA-O
ID: 61843
SMILES:C1CC(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 61844
SMILES:C1(C)(C)Oc2cc(CCCCC)c(-c3c(O)c(C(C)C)c4c(c3)C=CC(C)(C)O4)cc2c(=O)c2c1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.624
CB1 binding score: -16.268
InChIKey:WAICBNUVSDDTFT-UHFFFAOYSA-N
ID: 61845
SMILES:C(NCCCCC)Oc1c2c(cc(C)c1)OC(C)(C)C1C2CC(C)(OC)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 391.552
CB1 binding score: -14.65
InChIKey:LJZBHZPQJFHXOH-UHFFFAOYSA-N