ID: 58150
SMILES:C12C3C(=C)CCC1(O)C(C)(C)Oc1cc(CCCCC)cc(c12)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -13.197
InChIKey:TUDMDVRENXXTKQ-UHFFFAOYSA-N
ID: 58151
SMILES:O(C(=O)C(=CC)C)C(C(=C)C)(c1c(O)c2c(c(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)C=CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.727
CB1 binding score: -15.792
InChIKey:NCKJZLPMSKGOGJ-UHFFFAOYSA-N
ID: 58152
SMILES:Cc1c(C(C=C)(CC)C)cc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -14.027
InChIKey:LLTZXERVATYROL-UHFFFAOYSA-N
ID: 58153
SMILES:C1(C)C(C)(C2OC2)Oc2c(c(O)cc(CCCCC)c2)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -11.75
InChIKey:CYMPGEMAOYVNIV-UHFFFAOYSA-N
ID: 58154
SMILES:C(C1C=C2c3c(cc(CCCCC)cc3OC3C=C(C)CCC3C(C)(C)O2)OC1=O)=C(C)COC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.655
CB1 binding score: -14.732
InChIKey:HHKCHYNGPCDMRG-UHFFFAOYSA-N
ID: 58155
SMILES:C(CCC(=CCc1cc(O)c(C)cc1OC(C)=O)C)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.332
InChIKey:HAXRQCRJABYNJC-UHFFFAOYSA-N
ID: 58156
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: 58157
SMILES:C(C(CC=C(C1CC(c2c(O)cc(CCC)cc2O)OC1=O)C)C)CC(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -18.716
InChIKey:IZMMGOUKADWDSX-UHFFFAOYSA-N
ID: 58158
SMILES:Cc1c2c(ccc1)C(=O)C(c1c(O)cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -13.6
InChIKey:LXKVQOGFUYMZSO-UHFFFAOYSA-N
ID: 58159
SMILES:c1(=O)cc2c(ccc1CCC)OC(C)(C)C1CCC(C)=CC1=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -15.046
InChIKey:CGMNWPAJMFLNQY-UHFFFAOYSA-N
ID: 58160
SMILES:CC1(C)Oc2c(c(O)c(C=O)c(CCCCC)c2)-c2cc(O)c(CC=C(C)CCC=C(C)C)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 492.656
CB1 binding score: -15.751
InChIKey:KOSNEVWHSTVNAC-UHFFFAOYSA-N
ID: 58161
SMILES:C(C)(C)=CCCC(=CCc1c(OC)cc(CCCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -18.607
InChIKey:UHCTYPZAFAWOOW-UHFFFAOYSA-N
ID: 58162
SMILES:Oc1c(C2C(C(C)=C)C(c3c(OC)ccc(CCN(C)C)c3)CC(C)=C2)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.582
CB1 binding score: -13.155
InChIKey:KNVVDWYCTDVVSK-UHFFFAOYSA-N
ID: 58163
SMILES:C1(C)(C)C2C3C(C)(Oc4cc(CCCCC)cc(O)c41)C3C=C2C(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.24
InChIKey:XYZNNXCQAZSWBP-UHFFFAOYSA-N
ID: 58164
SMILES:c1(CC(C)C)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.14
InChIKey:FMGXBWXQUOYHHL-UHFFFAOYSA-N
ID: 58165
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C3=C(C)CCC3(C)C3C(C21)C3(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.546
CB1 binding score: -14.639
InChIKey:QFDMVXHEMUXWTQ-UHFFFAOYSA-N
ID: 58166
SMILES:O(c1cc(O)c2c(c1C)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.438
InChIKey:RBZCEBNZUCRCNT-UHFFFAOYSA-N
ID: 58167
SMILES:c1(O)cc(CCCCC)cc2c1C1C(C(O)(C)C)CCC(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -15.743
InChIKey:FQCKZMAMVAHGBO-UHFFFAOYSA-N
ID: 58168
SMILES:c1(O)c(CC=C(C)C)c(O)c(C=O)c(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -18.049
InChIKey:UTQODHOHWHAWHC-UHFFFAOYSA-N
ID: 58169
SMILES:c1(OC)c2c(cc(CCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.779
InChIKey:VXMYRUJLTHSFQU-UHFFFAOYSA-N
ID: 58170
SMILES:c1(C)c(-c2cc(C(CCCC)O)cc(O)c2)cc(C2C=C(C)CCC2C(C)=C)c(OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -14.67
InChIKey:DURKKOFNOZMLQF-UHFFFAOYSA-N