ID: 88558
SMILES:C1(CC23Oc4cc(CCCCC)cc(O)c4C2=CC(=O)CC3C)=CCCC(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -13.837
InChIKey:MZGPZEAMHHQYLG-UHFFFAOYSA-N
ID: 88559
SMILES:C(CCCC)c1cc(O)c2c(c1O)OC(CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.076
InChIKey:DGYADGILUPASIB-UHFFFAOYSA-N
ID: 88560
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -17.457
InChIKey:CWXKITARQPOZNY-UHFFFAOYSA-N
ID: 88561
SMILES:CCCCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 88562
SMILES:Cc1c(CCCCCC)cc(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.54
CB1 binding score: Not available
InChIKey:OPBQUYFHLREVLS-UHFFFAOYSA-N
ID: 88563
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3c4c(O)c(C(C)(C)OC)cc(O)c4C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.563
CB1 binding score: -16.254
InChIKey:LWULBMDHFGHFRB-UHFFFAOYSA-N
ID: 88564
SMILES:C12C3(C(C)(CCCC3=O)C)c3c(O)cc(CCCC)cc3OC1(C)CCC(C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -17.957
InChIKey:WSNFFIWNLIRPQY-UHFFFAOYSA-N
ID: 88565
SMILES:C(C)(=C)C1C(c2c(OC(=O)C)cc(CCCCC)cc2O)OC(C(C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.547
CB1 binding score: -15.116
InChIKey:QEJZSTYLEHAELA-UHFFFAOYSA-N
ID: 88566
SMILES:c1(C(=O)OC)cc(CC=C(C)CCC=C(C)C)c(O)cc1CCC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.527
InChIKey:ZDCMCEKIASCJIT-UHFFFAOYSA-N
ID: 88567
SMILES:C(O)(C)(C)C(CCC(C)=CCc1c(O)cc(CCC)c(C(O)=O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -16.318
InChIKey:FWXPNZCSVKFTEP-UHFFFAOYSA-N
ID: 88568
SMILES:O=Cc1c(O)c2c(cc1CCCCC)OC(CO)(C)C1CCC(C)(O)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -12.641
InChIKey:PEQLEKMLSMOKEC-UHFFFAOYSA-N
ID: 88569
SMILES:CC1(C)C2C(c3c(cc(CCCCC)c(C(=O)O)c3O)O1)C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 88570
SMILES:Oc1c(C(C(=C)C(C(C)C)C)=O)c2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.742
InChIKey:KZFBESHRSKOVRI-UHFFFAOYSA-N
ID: 88571
SMILES:c12c(c(O)cc(CCCCC)c1)OC(C)(C)C1C2CC(C)(O)C(O)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.519
CB1 binding score: -15.631
InChIKey:VQVGEJMMSIYHIK-UHFFFAOYSA-N
ID: 88572
SMILES:CC1(C)C2(C)C(=O)C(c3c(OC)cc(CCCC)cc3O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.029
InChIKey:HAILVNUHLJETDN-UHFFFAOYSA-N
ID: 88573
SMILES:C1CCC(=C)C2(Oc3c(c(O)cc(CCC)c3)C2)C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -13.74
InChIKey:OYVLEUOUGMWHOZ-UHFFFAOYSA-N
ID: 88574
SMILES:C1C=C(C)CC(c2c(O)cc(CCCCC)cc2O)(C(C)CCC=C(C)COC2OC(CO)C(O)C(O)C2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 562.744
CB1 binding score: -15.628
InChIKey:UENSWNMFTOJESM-UHFFFAOYSA-N
ID: 88575
SMILES:C(Oc1cc2c(cc1O)c1c(cc2C)OC(C)(C)C2CCC(C)=CC21)(=O)CC1CC=C(CC=CC)C(C)(C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 544.732
CB1 binding score: -13.535
InChIKey:PXXRHAAFYJHXMK-UHFFFAOYSA-N
ID: 88576
SMILES:CC(C)CCc1c(O)ccc2c1OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.307
InChIKey:IRCDGTZLCFUBKI-UHFFFAOYSA-N
ID: 88577
SMILES:C(CCC(=O)OCCCc1cc(OC)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -15.826
InChIKey:CKOVMBBZFIUOCA-UHFFFAOYSA-N
ID: 88578
SMILES:CC1(C)C2CC3c4c(cc(CCCCC)cc4OC13)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -12.577
InChIKey:UPZSLXNSJOSVQO-UHFFFAOYSA-N