ID: 67495
SMILES:C(C)(C)c1c(O)c2c(c3c1OC(CCC=C(C)C)(C)C=C3)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.908
InChIKey:VOUNNFJSGFTPJD-UHFFFAOYSA-N
ID: 67496
SMILES:c1c(CCCC)cc(O)c(C2C(C(C)=C)C(c3c(O)cc(CCCCC)c(C=O)c3O)CC2C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.673
CB1 binding score: -15.734
InChIKey:HACBGUMKGBKRFU-UHFFFAOYSA-N
ID: 67497
SMILES:C1CC2C(=CC1(C=O)C)c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.189
InChIKey:SCXNNIANNLDKBA-UHFFFAOYSA-N
ID: 67498
SMILES:C12CC([N+]#[C-])C(C1C)c1c(c(Br)c(C)cc1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.256
CB1 binding score: -16.581
InChIKey:QAKOSNMSSUCBCC-UHFFFAOYSA-N
ID: 67499
SMILES:COc1c(O)c(C)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.19
InChIKey:PBEHNVUOUXJYLR-UHFFFAOYSA-N
ID: 67500
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 67501
SMILES:C1=C(C)CC2c3c(O)cc(CCCCC)cc3OC(CCC=C(CCC=C(C)C)C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 450.707
CB1 binding score: -17.532
InChIKey:NVFGKTCXAKVKJZ-UHFFFAOYSA-N
ID: 67502
SMILES:C12(C)CC1c1c(cc(CCCCC)c(C(=O)O)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -13.968
InChIKey:XXNLMGPNWFKLGF-UHFFFAOYSA-N
ID: 67503
SMILES:c1(C)ccc2c(c1CCCC(C)(C)OC(C)=O)C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.16
InChIKey:JXWZIZPGURRQJL-UHFFFAOYSA-N
ID: 67504
SMILES:CC1(C)C(c2c(OC(=O)C)cc(CCCCC)cc2O)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.005
InChIKey:VXZWWRPQUAHZSX-UHFFFAOYSA-N
ID: 67505
SMILES:O=Cc1c(O)c2c(cc1)OC(C)(C)C1C(O)C(C(=C)C)CCC(C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -14.426
InChIKey:IVYDOECEMIHPKH-UHFFFAOYSA-N
ID: 67506
SMILES:c1(OC)cc(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 67507
SMILES:C1CCC(C)(C)C2C(=O)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -15.519
InChIKey:PIOOZSQHXQMUFG-UHFFFAOYSA-N
ID: 67508
SMILES:C12C(C(CCCl)O)(C)C(CCC(C)(C)O)Oc3c(c(OC)cc(CCCCC)c3)C1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 455.035
CB1 binding score: -14.14
InChIKey:BFLLWRZLJJMZQY-UHFFFAOYSA-N
ID: 67509
SMILES:C1(C)(C)OC2C(C)CC(c3c(O)c(C(=O)CCCC)cc(O)c3O)C(C)=C2CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.281
InChIKey:HLGHBBKZVSLYBX-UHFFFAOYSA-N
ID: 67510
SMILES:C(CCCCCCCCCCCCCCc1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.793
CB1 binding score: -16.202
InChIKey:AOBMTYIUVQBHCO-UHFFFAOYSA-N
ID: 67511
SMILES:c1c(O)cc(CCC)c2c1OC(C)(C)C1CC=C(C=O)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.338
InChIKey:HINXIDAKDPOESH-UHFFFAOYSA-N
ID: 67512
SMILES:O=C(c1c(O)cc(O)c2c1OC(C)(C)C1C2C(O)C(C)=CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.434
CB1 binding score: -15.324
InChIKey:RFBDEHXLNKHYNV-UHFFFAOYSA-N
ID: 67513
SMILES:O=C(C)c1cc(Cc2c(O)cc(CCCCC)cc2O)c(O)c(CC=C(CCC=C(C)C)C)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: Not available
InChIKey:BNQRXQDGXGYHGE-UHFFFAOYSA-N
ID: 67514
SMILES:CC1(C)C(O)CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C1CC(=O)C3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -14.376
InChIKey:LZVAXWMKKNSDGF-UHFFFAOYSA-N
ID: 67515
SMILES:c12c(cc(CCCCC)c(C(C(C)CC)=O)c1O)OC(C)(C)C1CCC(C)(C=C2)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.116
InChIKey:IVAGFROXZDOQMX-UHFFFAOYSA-N