ID: 138139
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CCC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.597
InChIKey:LQROZGZXFUAWIS-UHFFFAOYSA-N
ID: 138140
SMILES:c12cc(C=O)ccc1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -18.45
InChIKey:HXZOLVRQLAQLGI-UHFFFAOYSA-N
ID: 138141
SMILES:C(O)C1(O)c2c(O)cc(CCCCC)cc2CC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -13.522
InChIKey:KGYALGITRRLEGG-UHFFFAOYSA-N
ID: 138142
SMILES:CC1=C(C2C(C(C)=C)CCC(C)=C2)C(O)c2c(O)cc(C)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -12.397
InChIKey:PIQRJXJKYYJMGL-UHFFFAOYSA-N
ID: 138143
SMILES:c1(OC)c(C)cc(OC)cc1C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -18.235
InChIKey:XOIJUAOXCFNHIF-UHFFFAOYSA-N
ID: 138144
SMILES:CC1CC2C(C(=O)C1)C(C)(C)Oc1c2cc(OC)c(CC=C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.09
InChIKey:QCFZGEDQYSZJQB-UHFFFAOYSA-N
ID: 138145
SMILES:C1(C=C)(C)CCC2C(C)(C1)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -13.996
InChIKey:JDYTZJQEYBZKNP-UHFFFAOYSA-N
ID: 138146
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCC(C)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -16.317
InChIKey:YZPWVNDROAJDRB-UHFFFAOYSA-N
ID: 138147
SMILES:C1(C)(C)OC1C(OO)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.363
CB1 binding score: -15.467
InChIKey:COFOCJSXLSUEOG-UHFFFAOYSA-N
ID: 138148
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C(=O)O)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 138149
SMILES:C1(C)=CCC2C(C1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 138150
SMILES:CC1(C)Oc2cc(CCCCC)cc(OC)c2C2C1C1C(C(C)CC1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -13.658
InChIKey:TXEPDVFYLZYLSS-UHFFFAOYSA-N
ID: 138151
SMILES:c1c(OC)cc2c(c1Br)OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 337.257
CB1 binding score: -13.503
InChIKey:NEFNZNXOUHMQTH-UHFFFAOYSA-N
ID: 138152
SMILES:O=Cc1c(O)cc(C(C)C)c2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.331
InChIKey:PUKFXTMZNYLSHI-UHFFFAOYSA-N
ID: 138153
SMILES:C1(c2c(OC(C)=O)c(OC(=O)C)cc(CCCCC)c2)C=C(C)CC=C1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.527
CB1 binding score: -15.467
InChIKey:LGIZUDDMHUSGSC-UHFFFAOYSA-N
ID: 138154
SMILES:C12C(C(C)(C)O)CCC1(C)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.714
InChIKey:WHDCWMKMQFXAGU-UHFFFAOYSA-N
ID: 138155
SMILES:c1(C)c(C)c2c3c(c1)OC(C)(C)C1C3C=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 254.373
CB1 binding score: -12.258
InChIKey:CYPXARDCIQFQGQ-UHFFFAOYSA-N
ID: 138156
SMILES:C1C(CO)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.202
InChIKey:ALWMPONZFMJGTP-UHFFFAOYSA-N
ID: 138157
SMILES:CC(C(=O)c1cc(OC)c(O)c(C2C=C(C)CCC2C(=C)C)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -11.751
InChIKey:QJNZEZFMGWVIPJ-UHFFFAOYSA-N
ID: 138158
SMILES:c1(OCC=C(C)CC(O)C=C(C)C)cc(CCCCC)cc(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.048
InChIKey:YAUOBCXKOCSPJP-UHFFFAOYSA-N
ID: 138159
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C(C)CC1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.308
InChIKey:DWJYDGKCHNQPMT-UHFFFAOYSA-N