ID: 53026
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(CCC(CO)=C2)C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.166
InChIKey:VAAGETHXHNNULA-UHFFFAOYSA-N
ID: 53027
SMILES:C1(C)=CCC2C(C)(C)OC3=C(C(=O)C(C)C)C(=O)C1(O)C32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -11.79
InChIKey:QEUUADLOPVBHAG-UHFFFAOYSA-N
ID: 53028
SMILES:C(C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)C1OC(=O)C(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.5
CB1 binding score: -13.152
InChIKey:WFPYUPOUWFPXGC-UHFFFAOYSA-N
ID: 53029
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1C2CC(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 53030
SMILES:C1(C)(C)CCC(O)C2(C)C1CC(=O)C1(C)Oc3c(cc(CCCCC)cc3O)C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -11.876
InChIKey:CPFFYYIUNZJOAG-UHFFFAOYSA-N
ID: 53031
SMILES:C12C=C(C(=O)O)CCC1C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.994
InChIKey:WXGJTHWZSHNATO-UHFFFAOYSA-N
ID: 53032
SMILES:CC1C2(Oc3c(C(O)=O)c(CCCCC)cc(O)c31)CC(C(C)=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.742
InChIKey:YNHSDLFVHWNRNS-UHFFFAOYSA-N
ID: 53033
SMILES:C=Cc1c2c(cc(O)c1C=O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -12.131
InChIKey:GJXDSDGOHHIYKU-UHFFFAOYSA-N
ID: 53034
SMILES:OC(=O)c1c(CCCCC)cc2c3c1OC1(C)CC3OC(C)(C)C(O)C1C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.437
InChIKey:MIFQTMMMWPIJPG-UHFFFAOYSA-N
ID: 53035
SMILES:C(c1c(C=O)c(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)Cc1ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.496
CB1 binding score: -14.974
InChIKey:ICEMBGXPYKHZJG-UHFFFAOYSA-N
ID: 53036
SMILES:C1CC(C)(C)C2=CC(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.047
InChIKey:KXZMWXMUTQAILV-UHFFFAOYSA-N
ID: 53037
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 53038
SMILES:c1(C)cc(O)cc2c1-c1c(cc(CCCCC)cc1O)OC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.154
InChIKey:SRSXRZZSNYISAR-UHFFFAOYSA-N
ID: 53039
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.209
InChIKey:VPDBCGRUZCACNK-UHFFFAOYSA-N
ID: 53040
SMILES:OC12CC(O)C(=C)CC1c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.215
InChIKey:NOYAMLJJBCMSDZ-UHFFFAOYSA-N
ID: 53041
SMILES:C1(C)(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 53042
SMILES:Oc1ccc2c(c1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -16.82
InChIKey:HWSXTNQCABGCDM-UHFFFAOYSA-N
ID: 53043
SMILES:C(CC(CC1C=C(CO)C2C1(O)C1C(Oc3c(c(O)cc(CCCCC)c3)C(O)(C)C1)OC2=O)C=C(C)C)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 556.74
CB1 binding score: -14.751
InChIKey:SXTPIDGEMJBAKA-UHFFFAOYSA-N
ID: 53044
SMILES:C1(C)(C)Oc2c(c(O)c(C)c(OC)c2)C2C3=CC1CC2CC=C3C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.91
InChIKey:AITCITNBCCOAPI-UHFFFAOYSA-N
ID: 53045
SMILES:C(CC)CCCc1cc(O)c2c(c1)OC(C)(C)C1C(CC(=C)C)C2C(=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.396
InChIKey:PATFPEPXPBYBLH-UHFFFAOYSA-N
ID: 53046
SMILES:O=C(C)Oc1c2c(cc(C(C=C)(C)CCC=C(C)C)c1)OC(C)(C)C1C2C=C(C(OC)=O)CCC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -15.471
InChIKey:UHTUCVSDMJCAKC-UHFFFAOYSA-N