ID: 28771
SMILES:c1c(CCNC)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 301.43
CB1 binding score: -17.538
InChIKey:OOXPUPGAYGGCGA-UHFFFAOYSA-N
ID: 28772
SMILES:C(C1CCC(C)C2C(c3c(O)cc(CCCCC)cc31)O2)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -13.382
InChIKey:UYXCYPNYKCNOHS-UHFFFAOYSA-N
ID: 28773
SMILES:CC1(C)Oc2c(c(O)cc(CCC)c2)C2CC1CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.526
InChIKey:FDMCIOIBGFNBFK-UHFFFAOYSA-N
ID: 28774
SMILES:c12c(O)c(C(O)=O)c(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 28775
SMILES:C1C(C)=CC(c2c(O)cc(CCC)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.532
InChIKey:REOZWEGFPHTFEI-UHFFFAOYSA-N
ID: 28776
SMILES:C1(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 28777
SMILES:C1=C(C)CCC(C(=C)C)C1c1c(O)cc(O)c(C(CC(C)C)=O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -19.167
InChIKey:CFZLDEROOCUHHL-UHFFFAOYSA-N
ID: 28778
SMILES:C1=C(CCC=C(C)C)CC2c3c(O)cc(C)cc3OC(C)(C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -11.184
InChIKey:FEZWXRNERCGCNR-UHFFFAOYSA-N
ID: 28779
SMILES:C1(c2c(O)cc(CCCCC)c(OC)c2)CC(C)=CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.498
InChIKey:YTHYCKRBCPQDOE-UHFFFAOYSA-N
ID: 28780
SMILES:CC(c1cc(CCCC)cc(O)c1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 232.367
CB1 binding score: Not available
InChIKey:RKGZNCNDLZYCTC-UHFFFAOYSA-N
ID: 28781
SMILES:C(C(O)C(C)c1c(-c2c(C)ccc3ccccc32)c2c(c(C)c1)OC(C)(C)C1CCC(C)=CC21)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.708
CB1 binding score: -16.803
InChIKey:XRESSFKEYZWQSO-UHFFFAOYSA-N
ID: 28782
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)c(O)c2)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.023
InChIKey:AUSUIGFPHFBARQ-UHFFFAOYSA-N
ID: 28783
SMILES:c1(CCCCC)ccc(C2C=C(C)CCC2C(C)=C)c(OC(C)=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.438
InChIKey:ATJKXFOHYSSRNX-UHFFFAOYSA-N
ID: 28784
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 28785
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(O)(C)C2C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.608
InChIKey:FQILBSHXYWCPAM-UHFFFAOYSA-N
ID: 28786
SMILES:c1(C)c(O)cc2c(c1)C(C)(C)Oc1cc(CCCCC)ccc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -12.859
InChIKey:CEHSKGGIMRJHEL-UHFFFAOYSA-N
ID: 28787
SMILES:C1CC(O)(C)C(CCCC(=C)C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.586
InChIKey:NBGTVRQQHFBGOY-UHFFFAOYSA-N
ID: 28788
SMILES:CC1(C)C(c2cc(CCCCC)ccc2O)C(C(O)(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -18.668
InChIKey:NOJYBHBTSUPDGW-UHFFFAOYSA-N
ID: 28789
SMILES:c12c(O)c(O)c(CCCCC)cc1OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -18.012
InChIKey:UHVHVJGGPNBAJX-UHFFFAOYSA-N
ID: 28790
SMILES:C1=C(C=O)C=CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -16.974
InChIKey:BVONMZQAQKRPNW-UHFFFAOYSA-N
ID: 28791
SMILES:C1CC(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2O)C2(C)CCC(=O)C(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -16.167
InChIKey:KXKVEYPMHAMFNC-UHFFFAOYSA-N