ID: 105799
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCCC(C)C)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.334
InChIKey:ONLKZIJZHZKILI-UHFFFAOYSA-N
ID: 105800
SMILES:C1(C(=C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 105801
SMILES:c1c(CCCCC)cc2c(c1)OC1(C)CCCC(C)(C)C1C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.438
InChIKey:GXVOAZJXIPOMHU-UHFFFAOYSA-N
ID: 105802
SMILES:C(c1cc(O)c2c(c1)C=CC(C)(CCC=C(C=O)C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.519
InChIKey:IVJRLKMSWCELJZ-UHFFFAOYSA-N
ID: 105803
SMILES:C1C2c3c(O)cc(CCCCC)cc3OC(C)(C1(O)C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.717
InChIKey:OWWCOVCQCOMOHZ-UHFFFAOYSA-N
ID: 105804
SMILES:C1CC(C(C)C)CC2c3c(O)c(OC(C)=O)c(CCCCC)cc3OC12C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -15.259
InChIKey:VJMXCJFRZAUHPG-UHFFFAOYSA-N
ID: 105805
SMILES:c1c(CCCCC)cc(O)c(C2=CCCC(C)=C2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -14.109
InChIKey:OJTFXSSHENYERT-UHFFFAOYSA-N
ID: 105806
SMILES:C1CC(=O)C(C)(C)C2C1(C)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -17.564
InChIKey:AGIQPPINJINQGR-UHFFFAOYSA-N
ID: 105807
SMILES:Oc1cc(C=O)c2c(c1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.612
InChIKey:GYVUNJRFFJZKHH-UHFFFAOYSA-N
ID: 105808
SMILES:C1(C)=CCC(C(O)(C)C)CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -13.689
InChIKey:DXMRGVKFTFVXQW-UHFFFAOYSA-N
ID: 105809
SMILES:C(CC(C)=CCc1c(O)cc(CCCCC)cc1O)C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 105810
SMILES:c1c(OC)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -17.665
InChIKey:KKYQBIKHYRQVHJ-UHFFFAOYSA-N
ID: 105811
SMILES:c1(O)c(C2C(C(C)=C)CCC(C)=C2)c(C)c(O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.355
InChIKey:ZKUJAEAABPFPFG-UHFFFAOYSA-N
ID: 105812
SMILES:c1(O)c(CC=C(C)CCC=C(C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 105813
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)N2CC=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 353.55
CB1 binding score: -13.018
InChIKey:KDCNYMPQMZUMHO-UHFFFAOYSA-N
ID: 105814
SMILES:CC1(C)Oc2cc(CCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 105815
SMILES:CC(C)C1CC2c3c(cc(CCCCC)cc3O)OC(C)(CC1)C2O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.429
InChIKey:NSYFLYKUNIYJNR-UHFFFAOYSA-N
ID: 105816
SMILES:CC1(C)Oc2c(c(O)cc(C(CC(C)C)NC)c2)CC1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 293.407
CB1 binding score: -14.714
InChIKey:AJAKVTQOXOLXJZ-UHFFFAOYSA-N
ID: 105817
SMILES:c1(C=CC)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.182
InChIKey:BVHRCZARADNROI-UHFFFAOYSA-N
ID: 105818
SMILES:C12C(C(C)(C)Oc3cc(CCCCC)cc(OC(=O)C)c31)CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.813
InChIKey:LJSYERHLDDIYPW-UHFFFAOYSA-N
ID: 105819
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)C=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.32
InChIKey:WWYMYGIVLCKTBL-UHFFFAOYSA-N