ID: 111637
SMILES:c12c(O)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 111638
SMILES:C(Cc1c(O)cc(CCCCC)cc1O)=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 111639
SMILES:OC1C(O)C(c2c(O)cc(CCCCC)cc2OC)C(C(C)(C)O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.471
CB1 binding score: -14.222
InChIKey:KMAXGXOFLFKUOX-UHFFFAOYSA-N
ID: 111640
SMILES:C(C(OC1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.564
CB1 binding score: -12.218
InChIKey:JFXCOJUVOKIHGK-UHFFFAOYSA-N
ID: 111641
SMILES:C(CCC=O)c1cc(O)c(C2C(C(=O)C)CCC(C)(C)O2)cc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -13.862
InChIKey:JDIWUPRHTMHGSC-UHFFFAOYSA-N
ID: 111642
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(C)(O)C)cc1O)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.442
InChIKey:LBHVUPIOJUDSEE-UHFFFAOYSA-N
ID: 111643
SMILES:CC1(Oc2cc(O)cc(CCCCC)c2)C2CCC(C)C(C=C(C)C(=O)C)(C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.605
InChIKey:TUWBWNMKBZCXEG-UHFFFAOYSA-N
ID: 111644
SMILES:O=C1C=C(C)C2c3c(c(O)c(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.502
InChIKey:QQDKIZNADOZJQV-UHFFFAOYSA-N
ID: 111645
SMILES:C1(=O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.026
InChIKey:FJVJQPVMJALOMF-UHFFFAOYSA-N
ID: 111646
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.855
InChIKey:KBTNQOVTNZTJGJ-UHFFFAOYSA-N
ID: 111647
SMILES:Oc1c(C(C(C)CC)=O)c2c(c(OC)c1OC(CCC(OC)=O)=O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.577
CB1 binding score: -13.362
InChIKey:GITLJHILUJCPKO-UHFFFAOYSA-N
ID: 111648
SMILES:C(O)(c1cc(CC=C(C)C)c(C2C=C(C)CCC2C(C)=C)c(O)c1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.707
InChIKey:LUBPWXMDXPNZKU-UHFFFAOYSA-N
ID: 111649
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1(CC3C(C)(O1)CCCC3(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.4
InChIKey:IAIBHWSSKYAGCG-UHFFFAOYSA-N
ID: 111650
SMILES:c1(C(C)C)ccc2c(c1)OC(C)(C)C1C2CC(C=O)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.278
InChIKey:QVYZDUUEYPVMJD-UHFFFAOYSA-N
ID: 111651
SMILES:Oc1c(C2C(C(C)C)CCC2(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -16.793
InChIKey:LIQULMNBELGKPQ-UHFFFAOYSA-N
ID: 111652
SMILES:C12CC(C)(C)CC1C(O)c1cc(C(=O)O)c(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -18.26
InChIKey:JLABXZHMTSPERU-UHFFFAOYSA-N
ID: 111653
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 111654
SMILES:c1(O)cc(C)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.472
InChIKey:MRMJKDJYMLWPGM-UHFFFAOYSA-N
ID: 111655
SMILES:Oc1cc(C2C(C(C)=CCC=C(C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.465
InChIKey:OJYOTZWFSYIQBL-UHFFFAOYSA-N
ID: 111656
SMILES:C1(=O)C2=CCC3C(C)(C)Oc4cc(CCCCC)cc(C)c4C3CC2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -16.502
InChIKey:QTTXYDCFEKBVHY-UHFFFAOYSA-N
ID: 111657
SMILES:OC1CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.625
InChIKey:AAIHVZNCFQTVCA-UHFFFAOYSA-N