ID: 49078
SMILES:C(O)(CCC1(C)Oc2c(c(OC)cc(CCC=CC)c2)C2CC(C)=CCC21)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.466
InChIKey:AISRPSMOASNPJT-UHFFFAOYSA-N
ID: 49079
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(CO)C(O)CC1(C(=O)OC)CO2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -15.543
InChIKey:MEZADWRSFGKASG-UHFFFAOYSA-N
ID: 49080
SMILES:C1(C)(CO)C(C)(C)C2C(C1)c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.254
InChIKey:WQHDLVHXQZZVIW-UHFFFAOYSA-N
ID: 49081
SMILES:O(c1cc2c(cc1CCCCC)CC(C)(C)O2)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -14.881
InChIKey:SBCMONDUGOCBQC-UHFFFAOYSA-N
ID: 49082
SMILES:C1(CO)=CC2C(c3c(cc(CCCCC)cc3O)O2)C2C(C(OC(C)=O)C1O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -15.929
InChIKey:FCFZPFQPERAWMD-UHFFFAOYSA-N
ID: 49083
SMILES:Cc1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.527
InChIKey:ADYCLARNGCYRSF-UHFFFAOYSA-N
ID: 49084
SMILES:C12C(c3c(cc(CCC)cc3O)OC1(C)C)-c1c(cccc1)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.432
CB1 binding score: -16.915
InChIKey:HFMUODDKGFKVLY-UHFFFAOYSA-N
ID: 49085
SMILES:c1(O)cc(O)c(C(=O)C(CC)C)c2c1C1C(C(C)(C)O2)CC=C(CCC=C(C)C)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -12.432
InChIKey:UGIXBJTXUJVJSX-UHFFFAOYSA-N
ID: 49086
SMILES:Oc1c(CC=C(C)CCC=C(C)C)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.682
InChIKey:LDSLGHZIOIUHGN-UHFFFAOYSA-N
ID: 49087
SMILES:c12cc(C)cc3c1C(OC)(C(=O)C(C)(C)O3)CC(Cl)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.831
CB1 binding score: -13.787
InChIKey:QMZQMOWUMNMNPX-UHFFFAOYSA-N
ID: 49088
SMILES:C12(CCCC1=O)c1c(cc(CCCCC)cc1O)OC2CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -14.552
InChIKey:YWTSVNTUEXCHSZ-UHFFFAOYSA-N
ID: 49089
SMILES:CC1(C)Oc2cc(CCCCC)c(O)c3c2C(CC1O)OC3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -17.558
InChIKey:CZFFDOKEMRXSSX-UHFFFAOYSA-N
ID: 49090
SMILES:CC1=C2C(C(C)(C)Oc3cc(CCc4ccccc4)cc(O)c32)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.459
CB1 binding score: -16.536
InChIKey:ZSNAWUBGIFXIEH-UHFFFAOYSA-N
ID: 49091
SMILES:C1(C)(C)Oc2cc(CCCCC)cc3c2C2C(CC=C(CCC=C(C)C)C)(C2=O)C1C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.637
CB1 binding score: -14.823
InChIKey:HLTBJFQFLAOGQV-UHFFFAOYSA-N
ID: 49092
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)c1c-2cc(O)cc1)CNC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 327.424
CB1 binding score: -13.22
InChIKey:GOIXHSPSHVVQKI-UHFFFAOYSA-N
ID: 49093
SMILES:C1(C)C(C)(C)Oc2cc(CCCCC)c(C=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -14.896
InChIKey:ZHDUCMJUGBNNAB-UHFFFAOYSA-N
ID: 49094
SMILES:CC(C)C1C(=O)CC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.516
InChIKey:YOOCUYMYGYJRJM-UHFFFAOYSA-N
ID: 49095
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 49096
SMILES:CC(=C)C1C(c2cc(CCN(C)C)ccc2OC)C=C(C)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -17.933
InChIKey:DOIPOJKBLDXMNY-UHFFFAOYSA-N
ID: 49097
SMILES:C(CC)CCc1cc2c(c(O)c1)OC1(C)CC2C(CCC(=C)C)C(C)(C)C2CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.615
CB1 binding score: -15.929
InChIKey:RFPVYNLKIUNPJE-UHFFFAOYSA-N
ID: 49098
SMILES:C(C)(C1CC(C(C)C)C(c2c(O)cc(CCCC)cc2)C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.594
CB1 binding score: -16.211
InChIKey:BLKSESYNZSZQCN-UHFFFAOYSA-N