ID: 47986
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 47987
SMILES:O1C2(CC3C(C(C)(C)Oc4cc(CCCCC)ccc43)CC1)CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.385
InChIKey:OUDOTZWPPAWLSZ-UHFFFAOYSA-N
ID: 47988
SMILES:C1C2C(c3c(cc(CCCCC)cc3O)O1)CC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.309
InChIKey:PVGJMSRBGWGHGS-UHFFFAOYSA-N
ID: 47989
SMILES:COC(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.648
InChIKey:OTFNAKLRKKCSJT-UHFFFAOYSA-N
ID: 47990
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C(C)O)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.071
InChIKey:MHDFRNSBSJMEQS-UHFFFAOYSA-N
ID: 47991
SMILES:c1(C(=O)O)ccc2c(c1)OC(C)(C)C1CCC(CO)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.692
InChIKey:LGPAISDAUBWHFS-UHFFFAOYSA-N
ID: 47992
SMILES:C(O)C(C)=C1CC2C(C)(C)Oc3c(c(O)cc(CCCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -17.388
InChIKey:GPWRLGCCZZTWHL-UHFFFAOYSA-N
ID: 47993
SMILES:CC1=CC2c3c(cc(CCCCC)c(C(O)=O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 47994
SMILES:O=C(c1ccccc1)OC1C2c3c(cc(CCCCC)c(C(=O)O)c3O)OC2(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.585
CB1 binding score: -15.141
InChIKey:XDPXSUZUYRSKPF-UHFFFAOYSA-N
ID: 47995
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C(=O)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -13.82
InChIKey:VTXAVDIYVJBDEP-UHFFFAOYSA-N
ID: 47996
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 47997
SMILES:C(c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC(C)=CC1)=CCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.177
InChIKey:QTWMHHXZBCLMHH-UHFFFAOYSA-N
ID: 47998
SMILES:C12C(CC(=O)OC1)c1ccc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -14.727
InChIKey:YOTKSRBVQBMTTC-UHFFFAOYSA-N
ID: 47999
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 48000
SMILES:c12cc(CCCCC)cc(O)c1OC(CCC=C(C)C)(C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -19.028
InChIKey:BNDLCGBREIIGHD-UHFFFAOYSA-N
ID: 48001
SMILES:Cc1c(CCC(C)=O)c2c(c3c1OC(C)(C)C=C3)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -13.995
InChIKey:GIIZIBUIXRQSPL-UHFFFAOYSA-N
ID: 48002
SMILES:CC1CC(C)CCC12Oc1cc(CCCCCN=C=O)ccc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 371.521
CB1 binding score: -15.334
InChIKey:MSVQQGASYIGZHY-UHFFFAOYSA-N
ID: 48003
SMILES:C(CCc1c(O)c2c(c(C(=O)C=C(C)C)c1O)OC(C)(C)C1CCC(C)=CC21)CC(OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.579
CB1 binding score: -15.808
InChIKey:MSWMWKZXJPBQJP-UHFFFAOYSA-N
ID: 48004
SMILES:OCC(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.483
InChIKey:NOBVLNKOMCEFJL-UHFFFAOYSA-N
ID: 48005
SMILES:C1(C(C)(O)C)C(c2c(O)cc(CCCCC)cc2O)C(O)C(C)=CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.734
InChIKey:GYHATTBPRGZVJM-UHFFFAOYSA-N
ID: 48006
SMILES:C1(COC(=O)C)CC2(C)CCC3C(C)(C)Oc4c(c(O)cc(C)c4)C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.107
InChIKey:KOIILDDWIRNROO-UHFFFAOYSA-N