ID: 105043
SMILES:CC1=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 105044
SMILES:CC1=CC(c2c(O)cc(C)cc2O)C(C(C)=C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -12.98
InChIKey:UANZIKXKCDQSHE-UHFFFAOYSA-N
ID: 105045
SMILES:C1(C(C(O)=O)(C)C)CCC(C)=CC1c1c(O)cc(C(CCC)O)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.929
InChIKey:OUJNZQZRUGSKMI-UHFFFAOYSA-N
ID: 105046
SMILES:CC1(C)C2C1c1c(OC)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -15.813
InChIKey:RNXOOANUJUXMGF-UHFFFAOYSA-N
ID: 105047
SMILES:C1=CC(CCC=C(C)C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.334
InChIKey:AAXZFUQLLRMVOG-UHFFFAOYSA-N
ID: 105048
SMILES:C1CCC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.389
InChIKey:UHEDSPPIFUFKCL-UHFFFAOYSA-N
ID: 105049
SMILES:CC1(C)Oc2c(cc(O)c(C)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.091
InChIKey:DENJPBAXNZGHTK-UHFFFAOYSA-N
ID: 105050
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 105051
SMILES:c1(C(C)(C)C)cc(O)c2c(c1)OC(C)(C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.323
CB1 binding score: -16.579
InChIKey:XPDPBONPTSWDOY-UHFFFAOYSA-N
ID: 105052
SMILES:C1=C(C)C(O)C2C(C1=O)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.379
InChIKey:SGSNKVYFBOJVAH-UHFFFAOYSA-N
ID: 105053
SMILES:C1(=O)c2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.322
CB1 binding score: -19.037
InChIKey:WOUJHLUSTPDGBC-UHFFFAOYSA-N
ID: 105054
SMILES:C1(C(C)C)CCC(C)C(O)(c2c(O)cc(CCCCC)cc2OC)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.527
CB1 binding score: -16.501
InChIKey:YMTOLPAAJAFEHG-UHFFFAOYSA-N
ID: 105055
SMILES:C12(C)CCC(C(CO)(O)C)C3C1c1c(cc(CCCCC)cc1OC(C=C(C)C)=O)OC3C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -15.327
InChIKey:GJULCJULQDUZJW-UHFFFAOYSA-N
ID: 105056
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2OC)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.302
InChIKey:IPGGELGANIXRSX-UHFFFAOYSA-N
ID: 105057
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(OC)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.83
InChIKey:QIXSFKMWVIGJOK-UHFFFAOYSA-N
ID: 105058
SMILES:C1(C)(C)C2CC(=O)C(C)CC2c2c(ccc(O)c2)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -19.138
InChIKey:WZJGKXVSMHYLQM-UHFFFAOYSA-N
ID: 105059
SMILES:C12C(C)(C)Oc3ccc(CCCCC)cc3C1C(O)C(C)C13C(C2)C(O)(C)CC1OC3OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -16.924
InChIKey:OLWKAXCDSAYCBN-UHFFFAOYSA-N
ID: 105060
SMILES:O1c2cc(CCCCC)cc(OC)c2C2CC(C(=C)C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.8
InChIKey:AXSRHWBCTGKGNW-UHFFFAOYSA-N
ID: 105061
SMILES:CC(=CC1c2c(O)cc(CCC)cc2OC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.422
InChIKey:YYSDXBSBOHGSFB-UHFFFAOYSA-N
ID: 105062
SMILES:O=C(C)Oc1c(O)c2c(cc1CCCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.391
InChIKey:OTJZOKCYEUGKBJ-UHFFFAOYSA-N
ID: 105063
SMILES:C1C2C(C)(Oc3cc(C)cc(O)c32)C(=O)C=CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -13.923
InChIKey:PAKSJNUKDCJFGR-UHFFFAOYSA-N