ID: 82951
SMILES:C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 82952
SMILES:CC(=CCC(=O)C(=C)C)C1Oc2cc(O)cc(CCCC)c2C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -13.308
InChIKey:SIDJIZMXRCNLEH-UHFFFAOYSA-N
ID: 82953
SMILES:Oc1c2c(cc(CCCCC)c1)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: 82954
SMILES:c1(C(O)CC(OC)=O)cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -16.136
InChIKey:MJCIHZIFRFFNSG-UHFFFAOYSA-N
ID: 82955
SMILES:O=C1c2c(cc(CCCCC)c(C(=O)O)c2O)OC(C)(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.358
CB1 binding score: -16.445
InChIKey:RPQXUUDCZDHXHS-UHFFFAOYSA-N
ID: 82956
SMILES:C1C2(c3c(cc(CCCCC)cc3O)OC1CC(C)=C)CC(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.375
InChIKey:GJNBJNWBJTWCJY-UHFFFAOYSA-N
ID: 82957
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(O)c3)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.316
CB1 binding score: -16.921
InChIKey:AXBYMFVWTUCOCN-UHFFFAOYSA-N
ID: 82958
SMILES:C12CC(=C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 82959
SMILES:C(CCCCCOc1cc(C)c(O)c(CC=C(C)CCC=C(C)C)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.566
CB1 binding score: -15.001
InChIKey:WUJLYVABPJFQEX-UHFFFAOYSA-N
ID: 82960
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 82961
SMILES:c1c(CCCCC)cc2c(c1O)OC1(C)C3CC(C21)C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.929
InChIKey:PRAIKTSGIFHMSC-UHFFFAOYSA-N
ID: 82962
SMILES:C1(C(=C)C)CC2=CC3c4c(cc(CCCCC)c(C(=O)O)c4O)OC(C)(C)C2C3C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.327
InChIKey:YGMJPBQUTSZYNF-UHFFFAOYSA-N
ID: 82963
SMILES:C(CCc1cc2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.134
InChIKey:NFEIUGFKJUAJOO-UHFFFAOYSA-N
ID: 82964
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 82965
SMILES:C(c1c(O)c(CC=C(CCC=C(CC(C=C(C)C)O)C)C)cc(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.65
InChIKey:OXBACWLPZZEYPL-UHFFFAOYSA-N
ID: 82966
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(C(C)C)CC1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.853
InChIKey:SGMIWCSISJXPRG-UHFFFAOYSA-N
ID: 82967
SMILES:c1(O)cc(O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.859
InChIKey:WRBRAMOWKIFTPD-UHFFFAOYSA-N
ID: 82968
SMILES:C(=C)(C)C1C(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: 82969
SMILES:O1C2C(C)(C)C1Cc1c(O)c(C(O)=O)c(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -17.159
InChIKey:JZNXDHNECBKVBK-UHFFFAOYSA-N
ID: 82970
SMILES:c12c(c(CCCCC)cc(O)c1)OC(C)(C)C1CCC(C)=C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.945
InChIKey:JDRYWNVRHWWNAD-UHFFFAOYSA-N
ID: 82971
SMILES:C(CCC)Cc1cc(O)c2c(c1O)C1CC(CO)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.556
InChIKey:HHNDAUFJVOQKOO-UHFFFAOYSA-N