ID: 31795
SMILES:C(C1C(OC(C(CO)=CC)=O)CC(C)=CC1c1c(O)cc(CCCC)cc1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.541
InChIKey:NTHLKALDRJPJBI-UHFFFAOYSA-N
ID: 31796
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -17.844
InChIKey:DHOXLQJAMAKRMH-UHFFFAOYSA-N
ID: 31797
SMILES:c12c(oc3c1C(=O)C(OC(C)=O)(C)C=C3C=CC(C)C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.537
CB1 binding score: -13.737
InChIKey:JFSGENRJHCLYJG-UHFFFAOYSA-N
ID: 31798
SMILES:c12c(O)cc(CCCCC)cc1OC1(CC2)C2C(C)(C)C(CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.046
InChIKey:WXHPKLJVBVCFMB-UHFFFAOYSA-N
ID: 31799
SMILES:C1C(C)=CCc2c(OC(C)=O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -14.187
InChIKey:ZIKGLWRVLGQOQW-UHFFFAOYSA-N
ID: 31800
SMILES:CC1(C)C2C(C)(Cc3c(OS(=O)(O)=O)cc(CCCCC)cc3O2)C2(O)CCC(C)=CC2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.623
CB1 binding score: -14.772
InChIKey:XMSWNTIZZQMJKN-UHFFFAOYSA-N
ID: 31801
SMILES:CC1CC2c3c(O)cc(CCC)cc3OC1(C)CC2C(C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.725
InChIKey:PPJZDPRCNYEXPZ-UHFFFAOYSA-N
ID: 31802
SMILES:CC(=CCCC(=CCc1c(O)c(CCC(O)(C)C)c(CCc2ccccc2)cc1OC)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -14.149
InChIKey:IBIKLZXUCFAGEH-UHFFFAOYSA-N
ID: 31803
SMILES:c12c(c(CC=C(C)C)cc(C)c1)-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.449
CB1 binding score: -16.665
InChIKey:BTBWNQRRECKGEN-UHFFFAOYSA-N
ID: 31804
SMILES:C(=C(C)C)CCC(C)=CCc1c(C)c(O)c2ccc3c(c2c1)OC(C)(C)C1CCC(C)=CC13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.659
CB1 binding score: -14.546
InChIKey:PGEWRINHMTZJPD-UHFFFAOYSA-N
ID: 31805
SMILES:c12cc(CCCCC)cc(OC)c1OC(CCC=C(C)C)(C)C1CC21C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.541
InChIKey:PBZXCKJPFIEUBY-UHFFFAOYSA-N
ID: 31806
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1(CC(C(C)=C)CCC(C)=C1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.942
InChIKey:JWYYCCJXKLTNJM-UHFFFAOYSA-N
ID: 31807
SMILES:C(=CCCC(C1C(c2c(O)cc(CCCCC)cc2O)C(O)(C)CC1)C)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: Not available
InChIKey:REHSNWOODCWIFG-UHFFFAOYSA-N
ID: 31808
SMILES:O=C(C)Oc1c(CC=C(CCC=C(C)C)C)c(O)c(C2C=C(C)CCC2C(C)C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -16.198
InChIKey:OJQPSFXCOBYIHI-UHFFFAOYSA-N
ID: 31809
SMILES:O(C1C2C=C(C)CC3c4c(cc(CCCCC)cc4O)OC3(C)CCC2C(C)C1=O)C(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: -13.015
InChIKey:ZQPFWIRHPWSJBU-UHFFFAOYSA-N
ID: 31810
SMILES:C1=CC2(C)CCC3C(C)(C)Oc4c(c(O)cc(CCCCC)c4)CC3C1C(C)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.39
InChIKey:KYLHHNBDVBMEDU-UHFFFAOYSA-N
ID: 31811
SMILES:C1C(C)=CC(c2c(O)cc(CCCCCO)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.184
InChIKey:ZKGKOAJUWMGRFB-UHFFFAOYSA-N
ID: 31812
SMILES:Oc1cc(CCCC)cc2c1C1C(C(C=CC=C(C)C)=C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.518
CB1 binding score: -14.032
InChIKey:FMJHEXRDUCJYKF-UHFFFAOYSA-N
ID: 31813
SMILES:CC1=CCCC(C)=CCC(C)CC(O)C1c1c(O)c(C(OC)=O)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -15.717
InChIKey:OEVHUEILPJRINR-UHFFFAOYSA-N
ID: 31814
SMILES:Oc1c(OC)c2c(c(OC3C(O)C(O)C(O)C(CO)O3)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.5
CB1 binding score: -15.873
InChIKey:WMCLDMMPHBREPR-UHFFFAOYSA-N
ID: 31815
SMILES:C123C(C)(C4C(CC(C)CC4)C1(C)O)C(c1c(cc(CCCCC)cc1O)O2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.521
InChIKey:QQXDYPSYSDEVSV-UHFFFAOYSA-N