ID: 127093
SMILES:Brc1c(O)c(C(C(C)OCC)=O)c2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 439.346
CB1 binding score: -14.904
InChIKey:WVJDYMKBZYXMNY-UHFFFAOYSA-N
ID: 127094
SMILES:C1C(C(C)=C)C(c2c(O)c(O)cc(CCCCC)c2)CC(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.188
InChIKey:RPSHQGXUEPEXSY-UHFFFAOYSA-N
ID: 127095
SMILES:CC(C)CCc1c(O)c2c(cc1C)OC(C)(C)C1=CC=C(C)CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -16.781
InChIKey:NBDFVOQRXBJDRQ-UHFFFAOYSA-N
ID: 127096
SMILES:C(C)(CCCc1c(C)ccc2c1C=CC(C)(C)O2)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.346
InChIKey:WVSWMMSNBLAPFP-UHFFFAOYSA-N
ID: 127097
SMILES:C(C)(C1C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 127098
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 127099
SMILES:c12cc(C)ccc1CC1(C)C(C2)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 336.475
CB1 binding score: -16.212
InChIKey:WNOBAWMZNCOQLV-UHFFFAOYSA-N
ID: 127100
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(cc(O)c3CCCC(C)=C)C1=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.392
InChIKey:FEMDLROIRNFPHK-UHFFFAOYSA-N
ID: 127101
SMILES:O1c2cc(CCCCC)cc(OC)c2CC=C1CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.995
InChIKey:ZDSMCNKPILIRRY-UHFFFAOYSA-N
ID: 127102
SMILES:C1=CC2CC3(c4c(O)cc(CCCCC)cc4OC3)OC(C)(C)C2CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.011
InChIKey:MXGFVFJXLUQXDI-UHFFFAOYSA-N
ID: 127103
SMILES:C1(O)CC2(C)Oc3c(c(O)cc(C)c3)C(C2C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.992
InChIKey:PMQMVAJCELULFL-UHFFFAOYSA-N
ID: 127104
SMILES:C(C(=O)OC)c1c(O)cc2c(c1)OC(C)(C)C1C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -15.617
InChIKey:KURSKZAQADIKBY-UHFFFAOYSA-N
ID: 127105
SMILES:c1c2c(ccc1C)C1C(C(C)(C)O2)CC(OC(C)=O)C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.519
InChIKey:IPPPYVDBYAEKAT-UHFFFAOYSA-N
ID: 127106
SMILES:CC(Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -18.767
InChIKey:OGCCABVUOZBTQV-UHFFFAOYSA-N
ID: 127107
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127108
SMILES:O1c2c(c(O)cc(CCCC)c2)C2C=C(CCC3C(C)(CCC4C3(C)CCC=C4C)C2=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -15.65
InChIKey:JSVWFKKYLUGSDI-UHFFFAOYSA-N
ID: 127109
SMILES:O(c1cc2c(cc1)OC(C)(C)C1C2CC(C)C(=O)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -16.498
InChIKey:QLDXNIWDYGOJAI-UHFFFAOYSA-N
ID: 127110
SMILES:CC1(C)C2CCC(C)=CC2c2c(cc(CCCCC)cc2OC)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 127111
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 127112
SMILES:C1(O)(C(C)C)CCC(C)=CC1c1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.093
InChIKey:MCDPOKHXTOSYSL-UHFFFAOYSA-N
ID: 127113
SMILES:C1CC2(C)Oc3cc(CCCCC)cc(O)c3C2CC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.984
InChIKey:JBEHHYUQTNIXGO-UHFFFAOYSA-N