ID: 44668
SMILES:O(C)c1cc2c(c(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.954
InChIKey:MRZCUYAPLPCXMS-UHFFFAOYSA-N
ID: 44669
SMILES:C12(C)OC1CC(O)C(=C)Cc1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -17.922
InChIKey:IOFHEKLRNMIEIQ-UHFFFAOYSA-N
ID: 44670
SMILES:Oc1c(C(=O)CC(OCC)=O)ccc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -16.481
InChIKey:CIPZPFCOBOLJDW-UHFFFAOYSA-N
ID: 44671
SMILES:C(C)(CCCc1cc2c(c(O)c1)C(C)CC(=O)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -14.498
InChIKey:BARLOUXPGJBASY-UHFFFAOYSA-N
ID: 44672
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(OC)=O)(C)C21)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.93
InChIKey:GJIAGYJSLSFFJW-UHFFFAOYSA-N
ID: 44673
SMILES:C(CCC(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.599
InChIKey:MFXTVBNXLYXDDE-UHFFFAOYSA-N
ID: 44674
SMILES:C1c2c(O)cc(C)c(c2)-c2c(O)c(CC=C(CCC=C(C)CCC=C(C)C)COC(C)=O)c(O)c(C3C=C(C)CCC3C(C)=C)c2O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 640.861
CB1 binding score: -15.245
InChIKey:SIAMWBLWKUVCBJ-UHFFFAOYSA-N
ID: 44675
SMILES:C1CC(C)(C)OC2=C1c1cc3c(cc1O)OC(C)(C)C1C3(OC)C(C2)C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.568
InChIKey:ACTZFJIRIYVAPN-UHFFFAOYSA-N
ID: 44676
SMILES:C(=O)(C=CC(C)(C)O)c1c2c(ccc1O)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.421
InChIKey:RAUBECFJEPOZJD-UHFFFAOYSA-N
ID: 44677
SMILES:C1(C)(C)C2CCC(C)CC2c2cc(CCCCC)cc(O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.502
InChIKey:RRTCKFILLWCXSO-UHFFFAOYSA-N
ID: 44678
SMILES:C(=O)(CC)Oc1ccc(CCCC(CCCC2(C)CCc3cc(O)ccc3O2)C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -12.344
InChIKey:XMSGXLWKAXMCMC-UHFFFAOYSA-N
ID: 44679
SMILES:CC(C(c1cc(C2C=C(C)CCC2C(=C)C)c(O)cc1O)O)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.625
InChIKey:CMNLQATZSFWVBI-UHFFFAOYSA-N
ID: 44680
SMILES:C1(CC=C(C)C)Oc2c(C(=O)CC(C)C)c(O)cc(O)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -14.605
InChIKey:SLNRXFRQZGJSJI-UHFFFAOYSA-N
ID: 44681
SMILES:C(CCCCCCc1cc2c(c(OC)c1)C1C(C(C)(O)C)CCC(C)(C2)O1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.914
InChIKey:LQCDRXNIKZJYKB-UHFFFAOYSA-N
ID: 44682
SMILES:CCCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.821
InChIKey:CUWJKLPAOPPJHN-UHFFFAOYSA-N
ID: 44683
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCCC)c2)C2C1CCC(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.035
InChIKey:VJTPNTDNIGPZJJ-UHFFFAOYSA-N
ID: 44684
SMILES:COc1cc2c(cc1CCCCC)OC(C)(C)C1C(C2)C(C)=CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.929
InChIKey:BGLQOYYSBQDJBB-UHFFFAOYSA-N
ID: 44685
SMILES:C12C3c4c(cc(CCCCC)cc4O)OC(C)(C)OC3C3CCC(C)C3(C1)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.332
InChIKey:CWJNUEWKNWVUIW-UHFFFAOYSA-N
ID: 44686
SMILES:c12c(c(CC=C(C)C)cc(CCCC)c1O)OC(C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.605
InChIKey:BOIQIUBWOQLMCF-UHFFFAOYSA-N
ID: 44687
SMILES:C(CCCCCCC)c1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -18.344
InChIKey:WXNHXNFOIAUKTA-UHFFFAOYSA-N
ID: 44688
SMILES:C(C)(C=Cc1c(O)cc2c(c1O)C=CC(CCC=C(C)C)(C)O2)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.501
InChIKey:RWGMEARHDVHKCP-UHFFFAOYSA-N