ID: 104098
SMILES:O1c2cc(CCCCC)cc(O)c2C2C1(C)CCC2C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.819
InChIKey:KAMBAVCQZNPQOI-UHFFFAOYSA-N
ID: 104099
SMILES:O1c2cc(C)cc(O)c2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 216.28
CB1 binding score: -17.213
InChIKey:KJNSABUFNXECQP-UHFFFAOYSA-N
ID: 104100
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C(C(CC)C)=O)c3O)CC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.537
InChIKey:CNOCGENGHJHPFC-UHFFFAOYSA-N
ID: 104101
SMILES:c1(C2C(C(=C)C)CCC(C)=C2)c(O)c(CC=C(C)CCC=C(C)C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.636
InChIKey:ARVKBZZKUKHUHC-UHFFFAOYSA-N
ID: 104102
SMILES:C1=C(C(=O)O)CCC2C1C1c3c(ccc(CCCCC)c3)OC(C)(C)C1CC=C2C=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: Not available
InChIKey:SCUREHRBPBOHBV-UHFFFAOYSA-N
ID: 104103
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 104104
SMILES:Oc1c(C2C(C)=CCCC2C(C)=C)cc(O)c(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.929
InChIKey:DAWMLFHHHHKFJZ-UHFFFAOYSA-N
ID: 104105
SMILES:C12(COC(C)=O)CCC(C)=CC1Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -12.324
InChIKey:PLTZVBGCXTUUNZ-UHFFFAOYSA-N
ID: 104106
SMILES:C(c1c2c(c(OC)c(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -14.605
InChIKey:BLSZVQBDRXVTRX-UHFFFAOYSA-N
ID: 104107
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(=C)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.502
InChIKey:HDNJNVPZXVJOMB-UHFFFAOYSA-N
ID: 104108
SMILES:Oc1cc(O)c(C2C=C(C)CCC2C(=C)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -20.171
InChIKey:HFDMGJLGHZDMNB-UHFFFAOYSA-N
ID: 104109
SMILES:C(CCc1cc2c(cc1)C1C(CCC(CO)=C1)C(C)(C)O2)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.434
InChIKey:MWQURAJBVKFNIQ-UHFFFAOYSA-N
ID: 104110
SMILES:Oc1c(CC=C(C)C)c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.085
InChIKey:DXSKUBRMLHRYFY-UHFFFAOYSA-N
ID: 104111
SMILES:COC(=O)c1c(CC(C(O)(C)C)O)c2c(cc1C)OC(C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.428
CB1 binding score: -13.571
InChIKey:MCEPEMVTUXICPF-UHFFFAOYSA-N
ID: 104112
SMILES:CC12CC(O)C(C(C)(C)Oc3cc(CCCCC)cc(c3)C1)C=C(C(C)C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.631
CB1 binding score: -11.691
InChIKey:IDBUXLKEWNVIPJ-UHFFFAOYSA-N
ID: 104113
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -17.439
InChIKey:XVOPFYNMQOZUKH-UHFFFAOYSA-N
ID: 104114
SMILES:CC(C)=CCC=C(C)C1CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.243
InChIKey:IKUWJHOHFIBGMO-UHFFFAOYSA-N
ID: 104115
SMILES:COc1c(Cl)c2c(c(OC)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.832
CB1 binding score: -16.743
InChIKey:XCRDEIICJCPCFG-UHFFFAOYSA-N
ID: 104116
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(CCC=C(C)C)CCC12CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.626
CB1 binding score: -13.067
InChIKey:PZRNOWYZDVTSNB-UHFFFAOYSA-N
ID: 104117
SMILES:Oc1c(C2C(C(=C)C)CCC(C)=C2)c(OC)cc2c1c(C)ccc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.448
CB1 binding score: -14.881
InChIKey:WRLJXUBUBPORDO-UHFFFAOYSA-N
ID: 104118
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C=C(C(C)C)CCC1C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.594
InChIKey:MUQFLFNSHJHHCB-UHFFFAOYSA-N