ID: 12244
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCC=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: 12245
SMILES:C(CC1(C)Oc2c(cc(O)c(CC=C(C)C)c2)C=C1C)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.115
InChIKey:VKJFBLPBCDWPPR-UHFFFAOYSA-N
ID: 12246
SMILES:c1(CCCCC)ccc2c(c1)OC(C)(C)C1=C2C(=O)C(C)(O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.625
InChIKey:ZTSDLCQCINPQSM-UHFFFAOYSA-N
ID: 12247
SMILES:C(CCC=C(C)C)(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 12248
SMILES:Oc1cc(CCC)cc2c1C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 12249
SMILES:C12(C)Oc3c(c(O)cc(CCCCC)c3)C3C1(O)C(C(C)(C)C(OC(C)=O)C2)CCC3=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -15.742
InChIKey:VMDUGKPOBOGVNM-UHFFFAOYSA-N
ID: 12250
SMILES:CC1=CC(c2c(O)cc(OC)cc2O)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.286
InChIKey:VBGLQLUQKZRKHZ-UHFFFAOYSA-N
ID: 12251
SMILES:C1C=C(C)CCC(=O)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.153
InChIKey:XPDHPFKZRDLQRT-UHFFFAOYSA-N
ID: 12252
SMILES:Oc1cc(CCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 12253
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(OC)C(C)C1=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.938
InChIKey:RUKASSSRPFVXOQ-UHFFFAOYSA-N
ID: 12254
SMILES:CC1(C=CC=C(C)C)Oc2cc(CCCCC)c(C(OC)=O)c(O)c2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -16.014
InChIKey:UPAXYEDBXYQECQ-UHFFFAOYSA-N
ID: 12255
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 12256
SMILES:CC1C(=O)CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.853
InChIKey:UYILNTAXGHQCPI-UHFFFAOYSA-N
ID: 12257
SMILES:c12c(O)cc(C(C)CCCCCC)cc1OC(C)(C)C1C2CC(C)(O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -15.123
InChIKey:RZOVYHXMISPWBU-UHFFFAOYSA-N
ID: 12258
SMILES:c1(C(CC2=C(C)CCC2=O)C(C)(C)O)c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.697
InChIKey:BCKXAQKPTPEYCF-UHFFFAOYSA-N
ID: 12259
SMILES:CCCCCc1cc2c(c(O)c1)C1(O)C(C(C)(C)O2)CC(CC(=C)C)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.04
InChIKey:ZEOUCGYRCGKNCS-UHFFFAOYSA-N
ID: 12260
SMILES:c1(Cc2oc(C)cc2)cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.446
CB1 binding score: -15.022
InChIKey:FGRTZCOXLBIWKV-UHFFFAOYSA-N
ID: 12261
SMILES:C(CCCc1cc(O)c(C(O)=O)c2c1C(CC(OC)=O)C1=C(C)CCC1C(C)(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -16.989
InChIKey:LJGXAZWSHRQQTK-UHFFFAOYSA-N
ID: 12262
SMILES:C(=CC(CC(C)=CCc1c(O)c(C)cc(OC)c1)=O)c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.651
CB1 binding score: -15.259
InChIKey:BJHUOFQHCAPCTN-UHFFFAOYSA-N
ID: 12263
SMILES:C=C(C1CCC2(C)CC1c1c(cc(CCCCC)cc1O)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.198
InChIKey:NUXUDGMVYZUFNQ-UHFFFAOYSA-N
ID: 12264
SMILES:O=C1Cc2c(cc(CCCCC)cc2O)C2C(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.709
InChIKey:UOLXHAVUILXGGN-UHFFFAOYSA-N