ID: 56575
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 56576
SMILES:C1(=O)C2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)OC(C(C(OC)=O)C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.53
CB1 binding score: -13.329
InChIKey:JMVQJJGRVCLRMU-UHFFFAOYSA-N
ID: 56577
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(C)(C)C1CCC3=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.942
InChIKey:HCDOBVZPLOLZDI-UHFFFAOYSA-N
ID: 56578
SMILES:C(Cc1c(O)cc(CCCCC)c(C(O)=O)c1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 56579
SMILES:c1(CCCCC)cc2c(c(O)c1C(=O)O)CC(C(C)(C)O)C1(O)C(O)C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.626
CB1 binding score: -15.977
InChIKey:MJJFXYCAYJBZCS-UHFFFAOYSA-N
ID: 56580
SMILES:C(=C(C)C)C(=O)c1c(O)c2c(c(C(=O)CCCCC)c1)OC(C)(C)C1C2CC(C)(O)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -17.722
InChIKey:FTCFEUXURYYAIP-UHFFFAOYSA-N
ID: 56581
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)(O)C1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -17.069
InChIKey:PAEIGIJJBBPJFT-UHFFFAOYSA-N
ID: 56582
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 56583
SMILES:C(CC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 56584
SMILES:c1(C)c2c(c(C)cc1O)OC(C)(C)C1C2C=C(C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -15.714
InChIKey:UMQLGJOJPHCMED-UHFFFAOYSA-N
ID: 56585
SMILES:Oc1c2c(cc(CCCC(O)(C)C=O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -14.605
InChIKey:HVQXAAPBIWVBBQ-UHFFFAOYSA-N
ID: 56586
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -18.175
InChIKey:UKZRZEHRHBZAKF-UHFFFAOYSA-N
ID: 56587
SMILES:c1(CCC)c(O)c(C2C(C(C)=C)CC=C(C)C2)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.759
InChIKey:SYYYGQPTYFSOLC-UHFFFAOYSA-N
ID: 56588
SMILES:C1C(C(C)C)CC=C(C)C1c1c(O)cc(C(C=C)(C)CCC=C(C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.306
InChIKey:DNODXWYERSZHGC-UHFFFAOYSA-N
ID: 56589
SMILES:CC1=CC(c2ccc(CCCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.514
CB1 binding score: -17.334
InChIKey:DOYZQICPPHYJKF-UHFFFAOYSA-N
ID: 56590
SMILES:O(C(=O)C(=CC)C)C1C(=C)C2C(c3c(cc(CCCCC)cc3O)O2)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -15.887
InChIKey:BXRFOVYVUYVDOB-UHFFFAOYSA-N
ID: 56591
SMILES:CC(C)=CCCC(=CCc1c(O)c(C(O)=O)c(CCCCC)c(O)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.138
InChIKey:BZHWTNCHQIQETM-UHFFFAOYSA-N
ID: 56592
SMILES:C1Cc2c(CCCCC)cc(O)cc2OC1(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -16.655
InChIKey:KGJUMJYDBWHPMU-UHFFFAOYSA-N
ID: 56593
SMILES:CCC(C(=O)c1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.606
InChIKey:XOMRHMFMQNBCOJ-UHFFFAOYSA-N
ID: 56594
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1cc(CCCCCO)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 56595
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C1C=C(C(=O)O)CCC2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.448
InChIKey:DNYLUQCDKKZRBV-UHFFFAOYSA-N