ID: 117076
SMILES:c1(CC=C(CCC=C(C)C)C)cc(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.792
InChIKey:LTMDLXPPVFFIFP-UHFFFAOYSA-N
ID: 117077
SMILES:CC(Cc1cc(O)c2c(c1)OC(C)(C)C1OC(=O)C1(C)C2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -11.806
InChIKey:FHMPXYQHZZVWIS-UHFFFAOYSA-N
ID: 117078
SMILES:CC(C)C(=C)CCC1(C)Oc2c(cc(OC)c(C)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -15.365
InChIKey:JLKHIPZBXLUZEH-UHFFFAOYSA-N
ID: 117079
SMILES:C12CCC3C(C)(C)Oc4cc(C)cc(O)c4C(O)C1CC(=O)C23C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -13.192
InChIKey:ZFXVHTUEADVXFL-UHFFFAOYSA-N
ID: 117080
SMILES:OC(C(=O)c1cnc(O)c(C2C(C(=C)C)CCC(C)=C2)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 317.385
CB1 binding score: -13.629
InChIKey:IKRPJNVOLSPJBH-UHFFFAOYSA-N
ID: 117081
SMILES:O=C(O)C(=Cc1c(O)c(C2C=C(CO)CCC2C(C)=CCC=C(C)C)cc(O)c1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.498
CB1 binding score: -12.621
InChIKey:BCKVMRDTWDGMHL-UHFFFAOYSA-N
ID: 117082
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C=C(C)CC3OC(=O)C(=C3)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.363
InChIKey:FEBWIXVJXKXZNL-UHFFFAOYSA-N
ID: 117083
SMILES:C12C3=COC4(C)C(CCC(C14C)C=C2)C(C)(C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -15.745
InChIKey:NRHZASGOGHQRSN-UHFFFAOYSA-N
ID: 117084
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)c1c-2cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.696
InChIKey:WNKDAZLOXAUXJL-UHFFFAOYSA-N
ID: 117085
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(C)C)CCC(C)(O2)C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.385
InChIKey:OEDPJGVWHANUAE-UHFFFAOYSA-N
ID: 117086
SMILES:c1(O)cc(CCCCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 117087
SMILES:c1(CCCCCC)cc2c(c(OC)c1)C1C(C(C)=C)C3C(C)(CCC=C(C)C)CCC3(O)C(C)C1O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.76
CB1 binding score: -10.694
InChIKey:JMPGJBIYKTZDBE-UHFFFAOYSA-N
ID: 117088
SMILES:O1C(C)(C)C2C3C(C)(CCC2(C)c2c(O)cc(C)cc21)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.533
InChIKey:LQANJQWSJBTKSD-UHFFFAOYSA-N
ID: 117089
SMILES:C(CC(=CCc1c(O)cc(CCCCC)cc1O)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 117090
SMILES:C(=O)(CC(CC(=O)O)C(=O)OCC1C(C(C)=C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.697
CB1 binding score: -15.519
InChIKey:QHCGBESGWRJIHH-UHFFFAOYSA-N
ID: 117091
SMILES:Oc1c2c(cc(CCCCC)c1C(=O)O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.775
InChIKey:HRHJHXJQMNWQTF-UHFFFAOYSA-N
ID: 117092
SMILES:C(CCc1cc(O)c2c(c1CC=C(C)CCC=C(C)C)OC(=O)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.01
InChIKey:BPGWUYBSDAUUTM-UHFFFAOYSA-N
ID: 117093
SMILES:C1(O)CC(C(C)(O)C)C(c2cc(CCCC)ccc2OC(=O)C)C1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.259
InChIKey:GANJPHYHEPDXAR-UHFFFAOYSA-N
ID: 117094
SMILES:c1(C)c(-c2c(O)cc(CCCCC)cc2O)c2c(cc1)CCC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -11.735
InChIKey:QPOUQCXTOMILMR-UHFFFAOYSA-N
ID: 117095
SMILES:c12c(O)cc(CCCC)cc1OC1(C)C(C2)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.197
InChIKey:WMMCBTJIRWWNHT-UHFFFAOYSA-N
ID: 117096
SMILES:c1(O)c(OC(c2c(C)cc(O)cc2C)=O)c2c(cc1CCCC)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.602
CB1 binding score: -14.488
InChIKey:MQJQXHOUPKKRDH-UHFFFAOYSA-N