ID: 68734
SMILES:CC1=CC2=C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -14.741
InChIKey:XNFZRFKGLWWEKY-UHFFFAOYSA-N
ID: 68735
SMILES:C1(C)(C)Oc2cc(O)c3c(c2C1)CC1(O)C(C)C(O)C(O)C(C(C)=C)c1C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.125
InChIKey:RUPPKSLRLKGLGC-UHFFFAOYSA-N
ID: 68736
SMILES:CCCCCc1cc(O)c2c(c1)OC(C)(C)C1OC(C)(CCCC(C)=CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.217
InChIKey:MUXLBYHOFZIWLK-UHFFFAOYSA-N
ID: 68737
SMILES:CC(=O)Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 68738
SMILES:c12c(cc(C=O)cc1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -18.45
InChIKey:HXZOLVRQLAQLGI-UHFFFAOYSA-N
ID: 68739
SMILES:C12C(C)(Oc3c(c(OC)cc(CCCCC)c3)-1)CCC(=O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.509
InChIKey:BTWANOOLYLDZEC-UHFFFAOYSA-N
ID: 68740
SMILES:CC1(C)CC(OC2C(O)C(O)C(O)C(CO)O2)CC2(C)Oc3cc(CCCCC)cc(O)c3C3C(C)CCC213
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.717
CB1 binding score: -14.115
InChIKey:DHHKSBBAABXGLA-UHFFFAOYSA-N
ID: 68741
SMILES:CC1=CC2C(C(C)(C)Oc3c(C(=O)C(C)C)c(O)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -18.957
InChIKey:VIYAGNJWEOQORJ-UHFFFAOYSA-N
ID: 68742
SMILES:Oc1cc(C)cc2c1C1C3C(C)(CC=C3O)OC(=O)C(C=C(C)C)C1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -16.056
InChIKey:AYKMPUBZGACDEW-UHFFFAOYSA-N
ID: 68743
SMILES:O=C1C(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2O)C(C)(C)C(=O)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -11.598
InChIKey:UQTHHEGJEFHWBH-UHFFFAOYSA-N
ID: 68744
SMILES:CC1(C)Oc2c(CCCCC)cc(O)cc2C2C1CC1(O)C(C)(CCCC1C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.033
InChIKey:CNWACJJEVAHMEQ-UHFFFAOYSA-N
ID: 68745
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 68746
SMILES:Cc1cc(CC(C)=CCc2c(O)c(C=O)c(C)cc2)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.615
CB1 binding score: -15.929
InChIKey:HUEDGCNTAVNZJS-UHFFFAOYSA-N
ID: 68747
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 68748
SMILES:c1(CCCCC)c(C2C(C(C)C)CCC(C)=C2)c(O)cc(O)c1C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -7.095
InChIKey:DKGQVHKLLCZHQF-UHFFFAOYSA-N
ID: 68749
SMILES:c12cc(CCCCC)cc(OC3OC(CO)C(O)C(O)C3O)c1C1C3C(CCCC3(C)O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.61
CB1 binding score: -16.487
InChIKey:QYFPKLXIUYEQBK-UHFFFAOYSA-N
ID: 68750
SMILES:C1C2C(c3c(cc(CCCCCBr)cc3O)OC2(C)C)C(=O)C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 409.364
CB1 binding score: -14.956
InChIKey:OZTKXAMNQUBCEM-UHFFFAOYSA-N
ID: 68751
SMILES:C1(CC(C)=CCc2c(O)c(C)cc(OC)c2)C2(C)C(CC=C1C)C(C)(CCC(O)C(O)(C)C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 472.666
CB1 binding score: -13.501
InChIKey:JFZQMVZCFGNQEE-UHFFFAOYSA-N
ID: 68752
SMILES:CC1=CC2c3c(cc(CCC)cc3O)OC(C)(CCC1O)CCC2C(CCC=C(C)C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -20.261
InChIKey:NOSHAMISARAGFM-UHFFFAOYSA-N
ID: 68753
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C3(C)C(C(C)(C)CCC3)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.662
InChIKey:LVDOCXVOEIPWBZ-UHFFFAOYSA-N
ID: 68754
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.002
InChIKey:ITDDKOGKAGSKEJ-UHFFFAOYSA-N